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

Systemtic Name: 3-methyl-1-(4-methylpiperazin-1-yl)-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-(4-methylpiperazin-1-yl)-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-(4-methyl-1-piperazinyl)-2-octyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-(4-methylpiperazin-1-yl)-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-1-(4-methylpiperazino)-2-octyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C26H35N5 MolecularWeight: 417.5896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)C

Isomeric SMILES

CCCCCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)C

InChI

InChI=1S/C26H35N5/c1-4-5-6-7-8-9-12-21-20(2)22(19-27)25-28-23-13-10-11-14-24(23)31(25)26(21)30-17-15-29(3)16-18-30/h10-11,13-14H,4-9,12,15-18H2,1-3H3