N-[1-(cyanomethyl)-2-oxidanylidene-6-phenyl-azepan-3-yl]-4-(2-oxidanylidene-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide

Systemtic Name: N-[1-(cyanomethyl)-2-oxidanylidene-6-phenyl-azepan-3-yl]-4-(2-oxidanylidene-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide Openeye Name: N-[1-(cyanomethyl)-2-oxo-6-phenyl-azepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide CAS Name: N-[1-(cyanomethyl)-2-oxo-6-phenyl-3-azepanyl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)-1-piperidinecarboxamide IUPAC Name: N-[1-(cyanomethyl)-2-oxo-6-phenylazepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide Traditional Name: N-[1-(cyanomethyl)-2-keto-6-phenyl-azepan-3-yl]-4-(2-keto-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide Formula: C26H29N7O3 MolecularWeight: 487.55356

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(CC1C2=CC=CC=C2)CC#N)NC(=O)N3CCC(CC3)N4C5=C(NC4=O)N=CC=C5

Isomeric SMILES

C1CC(C(=O)N(CC1C2=CC=CC=C2)CC#N)NC(=O)N3CCC(CC3)N4C5=C(NC4=O)N=CC=C5

InChI

InChI=1S/C26H29N7O3/c27-12-16-32-17-19(18-5-2-1-3-6-18)8-9-21(24(32)34)29-25(35)31-14-10-20(11-15-31)33-22-7-4-13-28-23(22)30-26(33)36/h1-7,13,19-21H,8-11,14-17H2,(H,29,35)(H,28,30,36)