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

Systemtic Name: 1-(phenylmethyl)-4-[(3-phenyl-1H-pyrazol-5-yl)carbonyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-benzyl-4-(3-phenyl-1H-pyrazole-5-carbonyl)-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[oxo-(3-phenyl-1H-pyrazol-5-yl)methyl]-1-(phenylmethyl)-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-benzyl-4-(3-phenyl-1H-pyrazole-5-carbonyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-benzyl-4-(3-phenyl-1H-pyrazole-5-carbonyl)-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C28H27N5O3 MolecularWeight: 481.54568

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)CN1C(=O)C2=CC(=NN2)C3=CC=CC=C3)CC4=CC=CC=C4)OCC5=CC=CC=N5

Isomeric SMILES

C1C(CN(C(=O)CN1C(=O)C2=CC(=NN2)C3=CC=CC=C3)CC4=CC=CC=C4)OCC5=CC=CC=N5

InChI

InChI=1S/C28H27N5O3/c34-27-19-33(28(35)26-15-25(30-31-26)22-11-5-2-6-12-22)18-24(36-20-23-13-7-8-14-29-23)17-32(27)16-21-9-3-1-4-10-21/h1-15,24H,16-20H2,(H,30,31)