N-(3-chloranyl-2-methyl-phenyl)-2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[(4-cyano-3-methyl-1-pyrido[1,2-a]benzimidazolyl)thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-(4-cyano-3-methylpyrido[1,2-a]benzimidazol-1-yl)sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)thio]acetamide Formula: C22H17ClN4OS MolecularWeight: 420.91458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC4=C(C(=CC=C4)Cl)C)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC4=C(C(=CC=C4)Cl)C)C#N

InChI

InChI=1S/C22H17ClN4OS/c1-13-10-21(29-12-20(28)25-17-8-5-6-16(23)14(17)2)27-19-9-4-3-7-18(19)26-22(27)15(13)11-24/h3-10H,12H2,1-2H3,(H,25,28)