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

Systemtic Name: 1-[(4-methylphenyl)methylsulfanyl]-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-propyl-1-(p-tolylmethylsulfanyl)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(4-methylphenyl)methylthio]-3-propyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(4-methylphenyl)methylsulfanyl]-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(4-methylbenzyl)thio]-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C23H21N3S MolecularWeight: 371.49794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N3S/c1-3-6-18-13-22(27-15-17-11-9-16(2)10-12-17)26-21-8-5-4-7-20(21)25-23(26)19(18)14-24/h4-5,7-13H,3,6,15H2,1-2H3