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

Systemtic Name: 5-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methylene]barbituric acid Formula: C14H9ClN4O3 MolecularWeight: 316.69926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=NN2)C=C3C(=O)NC(=O)NC3=O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=NN2)C=C3C(=O)NC(=O)NC3=O)Cl

InChI

InChI=1S/C14H9ClN4O3/c15-9-3-1-7(2-4-9)11-8(6-16-19-11)5-10-12(20)17-14(22)18-13(10)21/h1-6H,(H,16,19)(H2,17,18,20,21,22)