4-(1-methylpiperidin-4-yl)carbonyl-1-(2-methylpropyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(1-methylpiperidin-4-yl)carbonyl-1-(2-methylpropyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-isobutyl-4-(1-methylpiperidine-4-carbonyl)-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[(1-methyl-4-piperidinyl)-oxomethyl]-1-(2-methylpropyl)-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(1-methylpiperidine-4-carbonyl)-1-(2-methylpropyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-4-(1-methylisonipecotoyl)-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C22H34N4O3 MolecularWeight: 402.53036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)C2CCN(CC2)C)OCC3=CC=CC=N3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)C2CCN(CC2)C)OCC3=CC=CC=N3

InChI

InChI=1S/C22H34N4O3/c1-17(2)12-25-13-20(29-16-19-6-4-5-9-23-19)14-26(15-21(25)27)22(28)18-7-10-24(3)11-8-18/h4-6,9,17-18,20H,7-8,10-16H2,1-3H3