3-[[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]methyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylmethyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NC3=CC=CC=C3N2CCC#N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NC3=CC=CC=C3N2CCC#N

InChI

InChI=1S/C19H20N4O2S2/c1-22(2)27(24,25)16-8-5-7-15(13-16)14-26-19-21-17-9-3-4-10-18(17)23(19)12-6-11-20/h3-5,7-10,13H,6,12,14H2,1-2H3