2-(1H-benzimidazol-2-yl)-2-cyano-N-(4-methylphenyl)ethanethioamide

Systemtic Name: 2-(1H-benzimidazol-2-yl)-2-cyano-N-(4-methylphenyl)ethanethioamide Openeye Name: 2-(1H-benzimidazol-2-yl)-2-cyano-N-(p-tolyl)thioacetamide CAS Name: 2-(1H-benzimidazol-2-yl)-2-cyano-N-(4-methylphenyl)ethanethioamide IUPAC Name: 2-(1H-benzimidazol-2-yl)-2-cyano-N-(4-methylphenyl)ethanethioamide Traditional Name: 2-(1H-benzimidazol-2-yl)-2-cyano-N-(p-tolyl)thioacetamide Formula: C17H14N4S MolecularWeight: 306.38486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)C(C#N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)C(C#N)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H14N4S/c1-11-6-8-12(9-7-11)19-17(22)13(10-18)16-20-14-4-2-3-5-15(14)21-16/h2-9,13H,1H3,(H,19,22)(H,20,21)