3-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-1-oxidanylidene-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-1-oxidanylidene-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-[[4-(azepane-1-carbonyl)-1-piperidyl]methyl]-1-oxo-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]methyl]-1-oxo-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile IUPAC Name: 3-[[4-(azepane-1-carbonyl)piperidin-1-yl]methyl]-1-oxo-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-[[4-(azepane-1-carbonyl)piperidino]methyl]-1-keto-4H-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)CC3=CC(=O)N4C5=CC=CC=C5N=C4C3C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)CC3=CC(=O)N4C5=CC=CC=C5N=C4C3C#N

InChI

InChI=1S/C25H29N5O2/c26-16-20-19(15-23(31)30-22-8-4-3-7-21(22)27-24(20)30)17-28-13-9-18(10-14-28)25(32)29-11-5-1-2-6-12-29/h3-4,7-8,15,18,20H,1-2,5-6,9-14,17H2