(5Z)-5-[5-(4-bromophenyl)-1-propanoyl-pyrazolidin-3-ylidene]-1-methyl-1,3-diazinane-2,4,6-trione

Systemtic Name: (5Z)-5-[5-(4-bromophenyl)-1-propanoyl-pyrazolidin-3-ylidene]-1-methyl-1,3-diazinane-2,4,6-trione Openeye Name: (5Z)-5-[5-(4-bromophenyl)-1-propanoyl-pyrazolidin-3-ylidene]-1-methyl-hexahydropyrimidine-2,4,6-trione CAS Name: (5Z)-5-[5-(4-bromophenyl)-1-(1-oxopropyl)-3-pyrazolidinylidene]-1-methyl-1,3-diazinane-2,4,6-trione IUPAC Name: (5Z)-5-[5-(4-bromophenyl)-1-propanoylpyrazolidin-3-ylidene]-1-methyl-1,3-diazinane-2,4,6-trione Traditional Name: (5Z)-5-[5-(4-bromophenyl)-1-propionyl-pyrazolidin-3-ylidene]-1-methyl-barbituric acid Formula: C17H17BrN4O4 MolecularWeight: 421.24528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=C2C(=O)NC(=O)N(C2=O)C)N1)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC(=O)N1C(C/C(=C/2\C(=O)NC(=O)N(C2=O)C)/N1)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H17BrN4O4/c1-3-13(23)22-12(9-4-6-10(18)7-5-9)8-11(20-22)14-15(24)19-17(26)21(2)16(14)25/h4-7,12,20H,3,8H2,1-2H3,(H,19,24,26)/b14-11-