(5E)-1-(3-methylphenyl)-5-[(1-phenylpyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: (5E)-1-(3-methylphenyl)-5-[(1-phenylpyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: (5E)-1-(m-tolyl)-5-[(1-phenylpyrazol-4-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: (5E)-1-(3-methylphenyl)-5-[(1-phenyl-4-pyrazolyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: (5E)-1-(3-methylphenyl)-5-[(1-phenylpyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: (5E)-1-(m-tolyl)-5-[(1-phenylpyrazol-4-yl)methylene]barbituric acid Formula: C21H16N4O3 MolecularWeight: 372.37674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C(=CC3=CN(N=C3)C4=CC=CC=C4)C(=O)NC2=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)/C(=C/C3=CN(N=C3)C4=CC=CC=C4)/C(=O)NC2=O

InChI

InChI=1S/C21H16N4O3/c1-14-6-5-9-17(10-14)25-20(27)18(19(26)23-21(25)28)11-15-12-22-24(13-15)16-7-3-2-4-8-16/h2-13H,1H3,(H,23,26,28)/b18-11+