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

Systemtic Name: 3-methyl-1-[4-(3-methylphenyl)carbonylpiperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-[4-(3-methylbenzoyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-[4-[(3-methylphenyl)-oxomethyl]-1-piperazinyl]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-[4-(3-methylbenzoyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-1-(4-m-toluoylpiperazino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C25H23N5O MolecularWeight: 409.48302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC(=C(C4=NC5=CC=CC=C5N34)C#N)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC(=C(C4=NC5=CC=CC=C5N34)C#N)C

InChI

InChI=1S/C25H23N5O/c1-17-6-5-7-19(14-17)25(31)29-12-10-28(11-13-29)23-15-18(2)20(16-26)24-27-21-8-3-4-9-22(21)30(23)24/h3-9,14-15H,10-13H2,1-2H3