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

Systemtic Name: 3-methyl-2-[(4-methylphenyl)methyl]-1-(octylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-(octylamino)-2-(p-tolylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-2-[(4-methylphenyl)methyl]-1-(octylamino)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-2-[(4-methylphenyl)methyl]-1-(octylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-2-(4-methylbenzyl)-1-(octylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C29H34N4 MolecularWeight: 438.60706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC4=CC=C(C=C4)C

Isomeric SMILES

CCCCCCCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC4=CC=C(C=C4)C

InChI

InChI=1S/C29H34N4/c1-4-5-6-7-8-11-18-31-28-24(19-23-16-14-21(2)15-17-23)22(3)25(20-30)29-32-26-12-9-10-13-27(26)33(28)29/h9-10,12-17,31H,4-8,11,18-19H2,1-3H3