2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-1-ethyl-benzimidazole-5-sulfonamide Formula: C17H16N4O2S3 MolecularWeight: 404.52954

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H16N4O2S3/c1-2-21-14-8-7-11(26(18,22)23)9-13(14)20-17(21)24-10-16-19-12-5-3-4-6-15(12)25-16/h3-9H,2,10H2,1H3,(H2,18,22,23)