1-[(4-chlorophenyl)methylsulfanyl]-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(4-chlorophenyl)methylsulfanyl]-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[(4-chlorophenyl)methylsulfanyl]-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(4-chlorophenyl)methylthio]-2-ethyl-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(4-chlorophenyl)methylsulfanyl]-2-ethyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(4-chlorobenzyl)thio]-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H18ClN3S MolecularWeight: 391.91642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3S/c1-3-17-14(2)18(12-24)21-25-19-6-4-5-7-20(19)26(21)22(17)27-13-15-8-10-16(23)11-9-15/h4-11H,3,13H2,1-2H3