2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-acetamide CAS Name: 2-[(4-cyano-3-ethyl-1-pyrido[1,2-a]benzimidazolyl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(4-cyano-3-ethylpyrido[1,2-a]benzimidazol-1-yl)sulfanylacetamide Traditional Name: N-benzyl-2-[(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)thio]acetamide Formula: C23H20N4OS MolecularWeight: 400.4961

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NCC4=CC=CC=C4)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NCC4=CC=CC=C4)C#N

InChI

InChI=1S/C23H20N4OS/c1-2-17-12-22(29-15-21(28)25-14-16-8-4-3-5-9-16)27-20-11-7-6-10-19(20)26-23(27)18(17)13-24/h3-12H,2,14-15H2,1H3,(H,25,28)