2-(1,3-benzothiazol-2-ylsulfanylmethyl)-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-1-ethyl-N,N-dimethyl-5-benzimidazolesulfonamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-1-ethyl-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C19H20N4O2S3 MolecularWeight: 432.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H20N4O2S3/c1-4-23-16-10-9-13(28(24,25)22(2)3)11-15(16)20-18(23)12-26-19-21-14-7-5-6-8-17(14)27-19/h5-11H,4,12H2,1-3H3