3-methyl-1-[2-(4-methylphenoxy)ethylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-methyl-1-[2-(4-methylphenoxy)ethylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-[2-(4-methylphenoxy)ethylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-[2-(4-methylphenoxy)ethylthio]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-[2-(4-methylphenoxy)ethylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-1-[2-(4-methylphenoxy)ethylthio]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)OCCSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)C

InChI

InChI=1S/C22H19N3OS/c1-15-7-9-17(10-8-15)26-11-12-27-21-13-16(2)18(14-23)22-24-19-5-3-4-6-20(19)25(21)22/h3-10,13H,11-12H2,1-2H3