2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]methyl]-1-ethyl-N,N-dimethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethyl-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[(4-cyclopropyl-5-keto-1H-1,2,4-triazol-3-yl)thio]methyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C17H22N6O3S2 MolecularWeight: 422.52498

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NNC(=O)N3C4CC4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NNC(=O)N3C4CC4

InChI

InChI=1S/C17H22N6O3S2/c1-4-22-14-8-7-12(28(25,26)21(2)3)9-13(14)18-15(22)10-27-17-20-19-16(24)23(17)11-5-6-11/h7-9,11H,4-6,10H2,1-3H3,(H,19,24)