5-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)methylene]barbituric acid Formula: C15H12N4O4 MolecularWeight: 312.28018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C(=O)NC(=O)NC3=O

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C(=O)NC(=O)NC3=O

InChI

InChI=1S/C15H12N4O4/c1-8-10(7-11-12(20)16-15(23)17-13(11)21)14(22)19(18-8)9-5-3-2-4-6-9/h2-7,18H,1H3,(H2,16,17,20,21,23)