5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione; ethanoic acid

Systemtic Name: 5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione; ethanoic acid Openeye Name: acetic acid; 5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: acetic acid; 5-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: acetic acid; 5-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: acetic acid; 5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]barbituric acid Formula: C17H15ClN4O5 MolecularWeight: 390.7778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C2C(=O)NC(=O)NC2=O)Cl)C3=CC=CC=C3.CC(=O)O

Isomeric SMILES

CC1=NN(C(=C1C=C2C(=O)NC(=O)NC2=O)Cl)C3=CC=CC=C3.CC(=O)O

InChI

InChI=1S/C15H11ClN4O3.C2H4O2/c1-8-10(7-11-13(21)17-15(23)18-14(11)22)12(16)20(19-8)9-5-3-2-4-6-9;1-2(3)4/h2-7H,1H3,(H2,17,18,21,22,23);1H3,(H,3,4)