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5-methyl-1,3-dihydrobenzimidazole-2-thione

UUID e0363942-1db1-4932-ad26-5863cad61a5b
Flow Object IDfo-de6bd6096bf900f3
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 61617-00-3
EC Numbers 262-872-0
prefLabel ⓘ
Language Value Provenance
en 5-methyl-1,3-dihydrobenzimidazole-2-thione
altLabel ⓘ
Language Value Provenance
en 2<em>H</em>-Benzimidazole-2-thione, 1,3-dihydro-4(<em>or</em> 5)-methyl-, zinc salt (2:1)
en Antioxidant ZMMBI
en Nocrac MMBZ
en Rhenogran ZMMBI 50
en Vanox ZMTI
en Vulkanox ZMB 2
en Vulkanox ZMBI
en ZMB 2
en ZMMBI
en ZMTI
en Zinc 2-mercaptotoluimidazole
en Zinc methylmercaptobenzimidazole
References
Shared Properties
Predicate Value
InChIKey CWIYBOJLSWJGKV-UHFFFAOYSA-N, GHPJYLIEFFVDGR-UHFFFAOYSA-L, LIVZWWLQNHAXBN-UHFFFAOYSA-N, RPIYIASMGNFNRZ-UHFFFAOYSA-L
InChI InChI=1S/2C8H8N2S.Zn/c1-5-2-3-6-7(4-5)10-8(11)9-6;1-5-3-2-4-6-7(5)10-8(11)9-6;/h2*2-4H,1H3,(H2,9,10,11);/q;;+2/p-2, InChI=1S/2C8H8N2S.Zn/c2*1-5-3-2-4-6-7(5)10-8(11)9-6;/h2*2-4H,1H3,(H2,9,10,11);/q;;+2/p-2, InChI=1S/C8H8N2S.Zn/c1-5-3-2-4-6-7(5)10-8(11)9-6;/h2-4H,1H3,(H2,9,10,11);, InChI=1S/C8H8N2S/c1-5-2-3-6-7(4-5)10-8(11)9-6/h2-4H,1H3,(H2,9,10,11)
IUPAC name 4-methyl-1,3-dihydrobenzimidazole-2-thione;zinc, 5-methyl-1,3-dihydrobenzimidazole-2-thione, zinc bis(4-methyl-1H-benzimidazole-2-thiolate), zinc;4-methyl-1H-benzimidazole-2-thiolate;6-methyl-1H-benzimidazole-2-thiolate
Molecular formula C16H14N4S2Zn, C8H8N2S, C8H8N2SZn
SMILES CC1=C2C(=CC=C1)NC(=N2)[S-].CC1=C2C(=CC=C1)NC(=N2)[S-].[Zn+2], CC1=C2C(=CC=C1)NC(=S)N2.[Zn], CC1=CC2=C(C=C1)N=C(N2)[S-].CC1=C2C(=CC=C1)NC(=N2)[S-].[Zn+2], CC1=CC2=C(C=C1)NC(=S)N2

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 e0363942-1db1-4932-ad26-5863cad61a5b zinc 4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide 7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 zinc 4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide 7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide Emissions/Emissions to air/Emissions to air, unspecified kg exactMatch —

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 — consensus_match group_key=zinc4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=61617-00-3; added Common Chemistry CAS names as altLabel: 2<em>H</em>-Benzimidazole-2-thione, 1,3-dihydro-4(<em>or</em> 5)-methyl-, zinc salt (2:1), Antioxidant ZMMBI, Nocrac MMBZ, Rhenogran ZMMBI 50, Vanox ZMTI, Vulkanox ZMB 2, Vulkanox ZMBI, ZMB 2, ZMMBI, ZMTI, Zinc 2-mercaptotoluimidazole, Zinc methylmercaptobenzimidazole; object_uuid=fo-de6bd6096bf900f3
cas_match_labels 1 — consensus_match group_key=zinc4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'61617-00-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-de6bd6096bf900f3: {'61617-00-3': 'exactMatch'}
prefLabel 1 — consensus_match group_key=zinc4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=61617-00-3; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0961; pubchem_entropy=3.9959; current_score=4.9161; pubchem_score=4.3559; score_improvement=0.5602; threshold=0.400; min_margin=0.400; object_uuid=fo-de6bd6096bf900f3

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'Zinc 4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide 7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': '5-methyl-1,3-dihydrobenzimidazole-2-thione', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'name:5-methyl-1,3-dihydrobenzimidazole-2-thione', 'https://pubchem.ncbi.nlm.nih.gov/compound/712373'], 'prov:wasDerivedFrom': 'pubchem preferred label selection'}}] group_key=zinc4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=61617-00-3; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0961; pubchem_entropy=3.9959; current_score=4.9161; pubchem_score=4.3559; score_improvement=0.5602; threshold=0.400; min_margin=0.400; object_uuid=fo-de6bd6096bf900f3
altLabel None [{'@value': 'Zinc 4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide 7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original EF name retained as altLabel'}}] group_key=zinc4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=61617-00-3; added current EF name as altLabel when prefLabel differs; object_uuid=fo-de6bd6096bf900f3
altLabel [{'@value': 'Zinc 4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide 7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original EF name retained as altLabel'}}] [{'@value': '2<em>H</em>-Benzimidazole-2-thione, 1,3-dihydro-4(<em>or</em> 5)-methyl-, zinc salt (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Antioxidant ZMMBI', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Nocrac MMBZ', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Rhenogran ZMMBI 50', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Vanox ZMTI', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Vulkanox ZMB 2', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Vulkanox ZMBI', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'ZMB 2', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'ZMMBI', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'ZMTI', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Zinc 2-mercaptotoluimidazole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Zinc methylmercaptobenzimidazole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:61617-00-3', 'https://commonchemistry.cas.org/detail?cas_rn=61617-00-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=zinc4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=61617-00-3; added Common Chemistry CAS names as altLabel: 2<em>H</em>-Benzimidazole-2-thione, 1,3-dihydro-4(<em>or</em> 5)-methyl-, zinc salt (2:1), Antioxidant ZMMBI, Nocrac MMBZ, Rhenogran ZMMBI 50, Vanox ZMTI, Vulkanox ZMB 2, Vulkanox ZMBI, ZMB 2, ZMMBI, ZMTI, Zinc 2-mercaptotoluimidazole, Zinc methylmercaptobenzimidazole; object_uuid=fo-de6bd6096bf900f3
cas_match_labels None {'61617-00-3': 'exactMatch'} group_key=zinc4-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide7-methyl-2-thioxo-2,3-dihydrobenzimidazol-1-ide||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'61617-00-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-de6bd6096bf900f3: {'61617-00-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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    "media": "Air",
    "strata": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
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      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
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      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 8.0718e-6
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    {
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