5-[[1-(3,4-dimethylphenyl)pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[1-(3,4-dimethylphenyl)pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[1-(3,4-dimethylphenyl)pyrazol-4-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[1-(3,4-dimethylphenyl)-4-pyrazolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[1-(3,4-dimethylphenyl)pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[1-(3,4-dimethylphenyl)pyrazol-4-yl]methylene]barbituric acid Formula: C16H14N4O3 MolecularWeight: 310.30736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(C=N2)C=C3C(=O)NC(=O)NC3=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C=N2)C=C3C(=O)NC(=O)NC3=O)C

InChI

InChI=1S/C16H14N4O3/c1-9-3-4-12(5-10(9)2)20-8-11(7-17-20)6-13-14(21)18-16(23)19-15(13)22/h3-8H,1-2H3,(H2,18,19,21,22,23)