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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C22H18ClN3S/c1-2-5-16-12-21(27-14-15-8-10-17(23)11-9-15)26-20-7-4-3-6-19(20)25-22(26)18(16)13-24/h3-4,6-12H,2,5,14H2,1H3