1-cyclohexyl-4-[(3-phenyl-1H-pyrazol-5-yl)carbonyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-[(3-phenyl-1H-pyrazol-5-yl)carbonyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-4-(3-phenyl-1H-pyrazole-5-carbonyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[oxo-(3-phenyl-1H-pyrazol-5-yl)methyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(3-phenyl-1H-pyrazole-5-carbonyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-4-(3-phenyl-1H-pyrazole-5-carbonyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CC(=NN3)C4=CC=CC=C4)OCC5=CN=CC=C5

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CC(=NN3)C4=CC=CC=C4)OCC5=CN=CC=C5

InChI

InChI=1S/C27H31N5O3/c33-26-18-31(27(34)25-14-24(29-30-25)21-9-3-1-4-10-21)16-23(35-19-20-8-7-13-28-15-20)17-32(26)22-11-5-2-6-12-22/h1,3-4,7-10,13-15,22-23H,2,5-6,11-12,16-19H2,(H,29,30)