3-methyl-1-[4-(2-methylphenyl)piperazin-1-yl]-2-prop-2-enyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-methyl-1-[4-(2-methylphenyl)piperazin-1-yl]-2-prop-2-enyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-allyl-3-methyl-1-[4-(o-tolyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-[4-(2-methylphenyl)-1-piperazinyl]-2-prop-2-enyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-[4-(2-methylphenyl)piperazin-1-yl]-2-prop-2-enylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-allyl-3-methyl-1-[4-(o-tolyl)piperazino]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C27H27N5 MolecularWeight: 421.53678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C3=C(C(=C(C4=NC5=CC=CC=C5N34)C#N)C)CC=C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C3=C(C(=C(C4=NC5=CC=CC=C5N34)C#N)C)CC=C

InChI

InChI=1S/C27H27N5/c1-4-9-21-20(3)22(18-28)26-29-23-11-6-8-13-25(23)32(26)27(21)31-16-14-30(15-17-31)24-12-7-5-10-19(24)2/h4-8,10-13H,1,9,14-17H2,2-3H3