3-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-1-oxidanylidene-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-1-oxidanylidene-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-1-oxo-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-[[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinyl]methyl]-1-oxo-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile IUPAC Name: 3-[[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]methyl]-1-oxo-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-keto-3-[[4-(2-methoxy-5-methyl-benzyl)piperazino]methyl]-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)CC3=CC(=O)N4C5=CC=CC=C5N=C4C3C#N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)CC3=CC(=O)N4C5=CC=CC=C5N=C4C3C#N

InChI

InChI=1S/C26H27N5O2/c1-18-7-8-24(33-2)20(13-18)17-30-11-9-29(10-12-30)16-19-14-25(32)31-23-6-4-3-5-22(23)28-26(31)21(19)15-27/h3-8,13-14,21H,9-12,16-17H2,1-2H3