1-[(2,5-dimethylphenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(2,5-dimethylphenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[(2,5-dimethylphenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(2,5-dimethylphenyl)methylthio]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(2,5-dimethylphenyl)methylsulfanyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(2,5-dimethylbenzyl)thio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H19N3S MolecularWeight: 357.47136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)C

InChI

InChI=1S/C22H19N3S/c1-14-8-9-15(2)17(10-14)13-26-21-11-16(3)18(12-23)22-24-19-6-4-5-7-20(19)25(21)22/h4-11H,13H2,1-3H3