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Environmental conditions, treatments and exposures ontology
Last uploaded:
February 14, 2023
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| Preferred Name | benzothiazole | |
| Synonyms |
1-Thia-3-azaindene Benzothiazol Benzosulfonazole BT BENZOTHIAZOLE 1,3-benzothiazole |
|
| Definitions |
An organic heterobicyclic compound that is a fusion product between benzene and thiazole. The parent of the class of benzothiazoles. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_45993 |
|
| bearer of |
http://purl.obolibrary.org/obo/CHEBI_76924 |
|
| charge |
0
|
|
| formula |
C7H5NS
|
|
| has exact synonym |
BENZOTHIAZOLE 1,3-benzothiazole
|
|
| has role |
http://purl.obolibrary.org/obo/CHEBI_76924 |
|
| hasOBONamespace |
chebi_ontology
|
|
| hasRelatedSynonym |
1-Thia-3-azaindene Benzothiazol Benzosulfonazole BT
|
|
| id |
CHEBI:45993
|
|
| inchi |
InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H
|
|
| inchikey |
IOJUPLGTWVMSFF-UHFFFAOYSA-N
|
|
| inSubset | ||
| label |
benzothiazole
|
|
| mass |
135.18734
|
|
| monoisotopicmass |
135.01427
|
|
| notation |
CHEBI:45993
|
|
| prefLabel |
benzothiazole
|
|
| smiles |
c1ccc2scnc2c1
|
|
| textual definition |
An organic heterobicyclic compound that is a fusion product between benzene and thiazole. The parent of the class of benzothiazoles.
|
|
| xRef |
PMID:15750776 Beilstein:109468 HMDB:HMDB0032930 PMID:24248888 PMID:23500410 UM-BBD_compID:c1128 Wikipedia:Benzothiazole CAS:95-16-9 PMID:18568896 DrugBank:DB08624 Reaxys:109468 PDBeChem:THZ
|
|
| subClassOf |
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