1-(4-bromophenyl)-5-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)hydrazinylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-bromophenyl)-5-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)hydrazinylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-bromophenyl)-5-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)hydrazono]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-bromophenyl)-5-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)hydrazinylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-bromophenyl)-5-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)hydrazinylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-bromophenyl)-5-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)hydrazono]barbituric acid Formula: C21H17BrN6O4 MolecularWeight: 497.30148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NN=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NN=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN6O4/c1-12-16(20(31)28(26(12)2)15-6-4-3-5-7-15)24-25-17-18(29)23-21(32)27(19(17)30)14-10-8-13(22)9-11-14/h3-11,24H,1-2H3,(H,23,29,32)