N-(2-cyanoethyl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]-N-phenyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]-N-phenyl-acetamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O2S/c1-2-26-16-9-10-17-18(13-16)23-20(22-17)27-14-19(25)24(12-6-11-21)15-7-4-3-5-8-15/h3-5,7-10,13H,2,6,12,14H2,1H3,(H,22,23)