N'-(1H-benzimidazol-2-ylsulfanyl)-N'-methyl-N-phenyl-butanediamide

Systemtic Name: N'-(1H-benzimidazol-2-ylsulfanyl)-N'-methyl-N-phenyl-butanediamide Openeye Name: N'-(1H-benzimidazol-2-ylsulfanyl)-N'-methyl-N-phenyl-butanediamide CAS Name: N'-(1H-benzimidazol-2-ylthio)-N'-methyl-N-phenylbutanediamide IUPAC Name: N'-(1H-benzimidazol-2-ylsulfanyl)-N'-methyl-N-phenylbutanediamide Traditional Name: N'-(1H-benzimidazol-2-ylthio)-N'-methyl-N-phenyl-succinamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CCC(=O)NC1=CC=CC=C1)SC2=NC3=CC=CC=C3N2

Isomeric SMILES

CN(C(=O)CCC(=O)NC1=CC=CC=C1)SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H18N4O2S/c1-22(25-18-20-14-9-5-6-10-15(14)21-18)17(24)12-11-16(23)19-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,19,23)(H,20,21)