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1-methyl-1-phenylthiourea

UUID 18be82ee-04d9-4922-9a9f-4a455782d149
Flow Object IDfo-e4c842704d36f4be
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 4104-75-0
EC Numbers 223-877-3
prefLabel
Language Value Provenance
en 1-methyl-1-phenylthiourea
altLabel ⓘ
Language Value Provenance
en <em>N</em>-Methyl-<em>N</em>-phenylthiourea
en NSC 87749
en Thiourea, <em>N</em>-methyl-<em>N</em>-phenyl-
en Urea, 1-methyl-1-phenyl-2-thio-
References
Shared Properties
Predicate Value
InChIKey LSYISTXVMMGLNA-UHFFFAOYSA-N, MCWZNJNWGQPUGL-UHFFFAOYSA-N
InChI InChI=1S/C16H18FN5O7/c1-6(23)26-4-9-11(27-7(2)24)12(28-8(3)25)15(29-9)22-5-19-10-13(17)20-16(18)21-14(10)22/h5,9,11-12,15H,4H2,1-3H3,(H2,18,20,21), InChI=1S/C8H10N2S/c1-10(8(9)11)7-5-3-2-4-6-7/h2-6H,1H3,(H2,9,11)
IUPAC name 1-methyl-1-phenyl-thiourea, 1-methyl-1-phenylthiourea, [3,4-diacetoxy-5-(2-amino-6-fluoro-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate, [3,4-diacetyloxy-5-(2-amino-6-fluoropurin-9-yl)oxolan-2-yl]methyl acetate, [3,4-diacetyloxy-5-(2-azanyl-6-fluoranyl-purin-9-yl)oxolan-2-yl]methyl ethanoate, acetic acid [3,4-diacetoxy-5-(2-amino-6-fluoro-purin-9-yl)tetrahydrofuran-2-yl]methyl ester, acetic acid [3,4-diacetyloxy-5-(2-amino-6-fluoro-9-purinyl)-2-oxolanyl]methyl ester
Molecular formula C16H18FN5O7, C8H10N2S
SMILES CC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3F)N)OC(=O)C)OC(=O)C, CN(C1=CC=CC=C1)C(=S)N

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 18be82ee-04d9-4922-9a9f-4a455782d149 1-methyl-1-phenylthiourea

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 1-methyl-1-phenylthiourea Emissions/Emissions to air/Emissions to air, indoor kg exactMatch —

Consolidated Field Provenance

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

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=1-methyl-1-phenylthiourea||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=4104-75-0; added Common Chemistry CAS names as altLabel: <em>N</em>-Methyl-<em>N</em>-phenylthiourea, NSC 87749, Thiourea, <em>N</em>-methyl-<em>N</em>-phenyl-, Urea, 1-methyl-1-phenyl-2-thio-; object_uuid=fo-e4c842704d36f4be
cas_match_labels 1 — consensus_match group_key=1-methyl-1-phenylthiourea||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'4104-75-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e4c842704d36f4be: {'4104-75-0': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
indoorUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '<em>N</em>-Methyl-<em>N</em>-phenylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4104-75-0', 'https://commonchemistry.cas.org/detail?cas_rn=4104-75-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 87749', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4104-75-0', 'https://commonchemistry.cas.org/detail?cas_rn=4104-75-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Thiourea, <em>N</em>-methyl-<em>N</em>-phenyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4104-75-0', 'https://commonchemistry.cas.org/detail?cas_rn=4104-75-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Urea, 1-methyl-1-phenyl-2-thio-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4104-75-0', 'https://commonchemistry.cas.org/detail?cas_rn=4104-75-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=1-methyl-1-phenylthiourea||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=4104-75-0; added Common Chemistry CAS names as altLabel: <em>N</em>-Methyl-<em>N</em>-phenylthiourea, NSC 87749, Thiourea, <em>N</em>-methyl-<em>N</em>-phenyl-, Urea, 1-methyl-1-phenyl-2-thio-; object_uuid=fo-e4c842704d36f4be
cas_match_labels None {'4104-75-0': 'exactMatch'} group_key=1-methyl-1-phenylthiourea||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'4104-75-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e4c842704d36f4be: {'4104-75-0': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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