2-(morpholin-4-ylsulfanyl)-1,3-benzothiazole

2-(4-Morpholinothio)benzothiazole
2-(4-Morpholinylmercapto)benzothiazole
2-(4-Morpholinylthio)benzothiazole
2-(Morpholinothio)benzothiazole
2-Benzothiazolesulfenemorpholide
2-Benzothiazolesulfenic acid morpholide
2-Benzothiazolyl N-morpholino sulfide
2-Benzothiazolylsulfenylmorpholine
4-(2-Benzothiazolylthio)morpholine
Accel NS
Accelerator NS
Amax
Benzothiazole, 2-(4-morpholinylthio)-
Benzothiazole, 2-(morpholinothio)-
Cure-rite OBTS
Delac MOR
MBS
Meramid M
Morpholine, 4-(2-benzothiazolylthio)-
Morpholinyl mercaptobenzothiazole
N,N-(Oxydiethylene)benzothiazole-2-sulfenamide
N-(Oxidiethylene)-2-benzothiazolyl sulfenamide
N-Morpholino-2-benzothiazolylsulfenamide
N-Oxydiethyl-2-benzothiazolesulfenamide
N-Oxydiethylene benzothiazole sulfenamide
N-Oxydiethylene-2-benzothiazolylsulfenamide
NOBS
NOBS Special
Nocceler MSA
Nocceler MSA-G
OBTS
Pilcure MOR
Rhenogran MBS 80
SA-M
Sanceler NOB
Santocure MBS
Santocure MOR
Soxinol NBS
Sulfenamide M
Sulfenax MOR
Vulcafor BSM
Vulcafor MBS
Vulkacit MOZ
Vulkacit MOZ/LG

Property	Value
InChI2D key string chemrof:inchi2d_key_string	MHKLKWCYGIBEQF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C11H12N2OS2/c1-2-4-10-9(3-1)12-11(15-10)16-13-5-7-14-8-6-13/h1-4H,5-8H2
IUPAC name chemrof:IUPAC_name	2-(morpholin-4-ylsulfanyl)-1,3-benzothiazole
Molecular formula chemrof:molecular_formula	C11H12N2OS2
Molecular mass chemrof:molecular_mass	252.364
Monoisotopic mass chemrof:monoisotopic_mass	252.039105
SMILES string chemrof:smiles_string	c1ccc2sc(SN3CCOCC3)nc2c1

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=102-77-2	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.002.776	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID0021096	enrich_references.pubchem_identifier_url
drugbank.ca	https://www.drugbank.ca/drugs/DB14202	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=70078	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1530581	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/VCD7623F3K	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.600E	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=154864	enrich_references.pubchem_identifier_url
platform.opentargets.org	https://platform.opentargets.org/drug/CHEMBL1530581	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/7619	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=125357	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q27291760	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
6c313367-3690-4f0a-96f2-4804d18c7415	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
140f87a7-baeb-4bf5-bb3b-21eae1dfa8c2	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
7699fd86-92cd-415e-b330-4a793a0dbfc6	Environmental → Air → Indoor	EF 3.1	kg	4
cf06c83b-340d-43a0-8006-fb8be985f70d	Environmental → Air → Long-term	EF 3.1	kg	0
74c8a5db-7860-4f0a-9777-e131ff3a2ca8	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
e8140fe3-5a74-424d-a882-113847ccb9a7	Environmental → Air → Unknown	EF 3.1	kg	4
a87984c4-a34f-476e-96d3-cc17efe65d1f	Environmental → Ground → Agricultural	EF 3.1	kg	4
ed5059ca-bcfc-406c-93d1-258953397f6e	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
70ad518c-7fe4-4b36-aab0-dd3b71052324	Environmental → Ground → Unknown	EF 3.1	kg	4
48ecde4e-853c-44bf-99e3-ff93eb707260	Environmental → Water → Long-term	EF 3.1	kg	0
8036bcfa-3da6-455b-9d55-9c76811a176f	Environmental → Water → Ocean	EF 3.1	kg	4
0ff0c431-103b-4ba8-bde2-595abdeab423	Environmental → Water → Surface water	EF 3.1	kg	4
2c62cb11-02ca-4545-9b5b-efa4dd5f9185	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-6fba0cd35771c5ba",
  "prefLabel": [
    {
      "@value": "2-(morpholin-4-ylsulfanyl)-1,3-benzothiazole",
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        "prov:wasDerivedFrom": "legacy name field"
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  ],
  "altLabel": [
    {
      "@value": "2-(4-Morpholinothio)benzothiazole",
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    },
    {
      "@value": "2-(4-Morpholinylmercapto)benzothiazole",
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    },
    {
      "@value": "2-(4-Morpholinylthio)benzothiazole",
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    {
      "@value": "2-(Morpholinothio)benzothiazole",
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    {
      "@value": "2-Benzothiazolesulfenemorpholide",
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    {
      "@value": "2-Benzothiazolesulfenic acid morpholide",
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    },
    {
      "@value": "2-Benzothiazolyl N-morpholino sulfide",
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    },
    {
      "@value": "2-Benzothiazolylsulfenylmorpholine",
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    },
    {
      "@value": "4-(2-Benzothiazolylthio)morpholine",
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      "provenance": {
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    },
    {
      "@value": "Accel NS",
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    },
    {
      "@value": "Accelerator NS",
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    },
    {
      "@value": "Amax",
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    },
    {
      "@value": "Benzothiazole, 2-(4-morpholinylthio)-",
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        ],
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      }
    },
    {
      "@value": "Benzothiazole, 2-(morpholinothio)-",
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    },
    {
      "@value": "Cure-rite OBTS",
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      }
    },
    {
      "@value": "Delac MOR",
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      "provenance": {
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      }
    },
    {
      "@value": "MBS",
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      }
    },
    {
      "@value": "Meramid M",
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    },
    {
      "@value": "Morpholine, 4-(2-benzothiazolylthio)-",
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    },
    {
      "@value": "Morpholinyl mercaptobenzothiazole",
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    },
    {
      "@value": "N,N-(Oxydiethylene)benzothiazole-2-sulfenamide",
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      }
    },
    {
      "@value": "N-(Oxidiethylene)-2-benzothiazolyl sulfenamide",
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        ],
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    },
    {
      "@value": "N-Morpholino-2-benzothiazolylsulfenamide",
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      }
    },
    {
      "@value": "N-Oxydiethyl-2-benzothiazolesulfenamide",
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      }
    },
    {
      "@value": "N-Oxydiethylene benzothiazole sulfenamide",
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      "@value": "N-Oxydiethylene-2-benzothiazolylsulfenamide",
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      }
    },
    {
      "@value": "NOBS",
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      }
    },
    {
      "@value": "NOBS Special",
      "@language": "en",
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      }
    },
    {
      "@value": "Nocceler MSA",
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    },
    {
      "@value": "Nocceler MSA-G",
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      "@value": "OBTS",
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    },
    {
      "@value": "Pilcure MOR",
      "@language": "en",
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    {
      "@value": "Rhenogran MBS 80",
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    {
      "@value": "SA-M",
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    },
    {
      "@value": "Sanceler NOB",
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2-(morpholin-4-ylsulfanyl)-1,3-benzothiazole

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

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