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

Systemtic Name: 4-(2-oxidanylidene-3H-imidazo[4,5-b]pyridin-1-yl)-N-[(3R)-2-oxidanylidene-6-thiophen-3-yl-azepan-3-yl]piperidine-1-carboxamide Openeye Name: 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)-N-[(3R)-2-oxo-6-(3-thienyl)azepan-3-yl]piperidine-1-carboxamide CAS Name: 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)-N-[(3R)-2-oxo-6-(3-thiophenyl)-3-azepanyl]-1-piperidinecarboxamide IUPAC Name: 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)-N-[(3R)-2-oxo-6-thiophen-3-ylazepan-3-yl]piperidine-1-carboxamide Traditional Name: 4-(2-keto-3H-imidazo[4,5-b]pyridin-1-yl)-N-[(3R)-2-keto-6-(3-thienyl)azepan-3-yl]piperidine-1-carboxamide Formula: C22H26N6O3S MolecularWeight: 454.54524

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NCC1C2=CSC=C2)NC(=O)N3CCC(CC3)N4C5=C(NC4=O)N=CC=C5

Isomeric SMILES

C1CC(CNC(=O)[C@@H]1NC(=O)N2CCC(CC2)N3C4=C(NC3=O)N=CC=C4)C5=CSC=C5

InChI

InChI=1S/C22H26N6O3S/c29-20-17(4-3-14(12-24-20)15-7-11-32-13-15)25-21(30)27-9-5-16(6-10-27)28-18-2-1-8-23-19(18)26-22(28)31/h1-2,7-8,11,13-14,16-17H,3-6,9-10,12H2,(H,24,29)(H,25,30)(H,23,26,31)/t14?,17-/m1/s1