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

Systemtic Name: 2-ethyl-3-methyl-1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-ethyl-3-methyl-1-[4-(o-tolylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 2-ethyl-3-methyl-1-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-ethyl-3-methyl-1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-ethyl-3-methyl-1-[4-(2-methylbenzyl)piperazino]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C27H29N5 MolecularWeight: 423.55266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)CC5=CC=CC=C5C

Isomeric SMILES

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)CC5=CC=CC=C5C

InChI

InChI=1S/C27H29N5/c1-4-22-20(3)23(17-28)26-29-24-11-7-8-12-25(24)32(26)27(22)31-15-13-30(14-16-31)18-21-10-6-5-9-19(21)2/h5-12H,4,13-16,18H2,1-3H3