1-(2-bromanyl-4,5-dimethyl-phenyl)-5-[(oxidanylamino)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(2-bromanyl-4,5-dimethyl-phenyl)-5-[(oxidanylamino)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(2-bromo-4,5-dimethyl-phenyl)-5-[(hydroxyamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(2-bromo-4,5-dimethylphenyl)-5-[(hydroxyamino)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(2-bromo-4,5-dimethylphenyl)-5-[(hydroxyamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2-bromo-4,5-dimethyl-phenyl)-5-[(hydroxyamino)methylene]barbituric acid Formula: C13H12BrN3O4 MolecularWeight: 354.15608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)Br)N2C(=O)C(=CNO)C(=O)NC2=O

Isomeric SMILES

CC1=CC(=C(C=C1C)Br)N2C(=O)C(=CNO)C(=O)NC2=O

InChI

InChI=1S/C13H12BrN3O4/c1-6-3-9(14)10(4-7(6)2)17-12(19)8(5-15-21)11(18)16-13(17)20/h3-5,15,21H,1-2H3,(H,16,18,20)