5-[2-ethanoyl-3-(3-methoxyphenyl)-3,4-dihydropyrazol-5-yl]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[2-ethanoyl-3-(3-methoxyphenyl)-3,4-dihydropyrazol-5-yl]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[2-acetyl-3-(3-methoxyphenyl)-3,4-dihydropyrazol-5-yl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[2-acetyl-3-(3-methoxyphenyl)-3,4-dihydropyrazol-5-yl]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[2-acetyl-3-(3-methoxyphenyl)-3,4-dihydropyrazol-5-yl]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[1-acetyl-5-(3-methoxyphenyl)-2-pyrazolin-3-yl]barbituric acid Formula: C16H16N4O5 MolecularWeight: 344.32204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C2C(=O)NC(=O)NC2=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC(=O)N1C(CC(=N1)C2C(=O)NC(=O)NC2=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C16H16N4O5/c1-8(21)20-12(9-4-3-5-10(6-9)25-2)7-11(19-20)13-14(22)17-16(24)18-15(13)23/h3-6,12-13H,7H2,1-2H3,(H2,17,18,22,23,24)