3-methyl-1-[(3-methylphenyl)amino]-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-methyl-1-[(3-methylphenyl)amino]-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-(3-methylanilino)-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-(3-methylanilino)-2-octyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-(3-methylanilino)-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-1-(m-toluidino)-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C28H32N4 MolecularWeight: 424.58048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NC4=CC=CC(=C4)C

Isomeric SMILES

CCCCCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NC4=CC=CC(=C4)C

InChI

InChI=1S/C28H32N4/c1-4-5-6-7-8-9-15-23-21(3)24(19-29)28-31-25-16-10-11-17-26(25)32(28)27(23)30-22-14-12-13-20(2)18-22/h10-14,16-18,30H,4-9,15H2,1-3H3