5-[[1-(4-methylphenyl)-6-oxidanyl-4-oxidanylidene-3-phenyl-2-sulfanylidene-pyrimidin-5-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[1-(4-methylphenyl)-6-oxidanyl-4-oxidanylidene-3-phenyl-2-sulfanylidene-pyrimidin-5-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[4-hydroxy-6-oxo-1-phenyl-3-(p-tolyl)-2-thioxo-pyrimidin-5-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-3-phenyl-2-sulfanylidene-5-pyrimidinyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-3-phenyl-2-sulfanylidenepyrimidin-5-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[4-hydroxy-6-keto-1-phenyl-3-(p-tolyl)-2-thioxo-pyrimidin-5-yl]methylene]barbituric acid Formula: C22H16N4O5S MolecularWeight: 448.45124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=O)N(C2=S)C3=CC=CC=C3)C=C4C(=O)NC(=O)NC4=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=O)N(C2=S)C3=CC=CC=C3)C=C4C(=O)NC(=O)NC4=O)O

InChI

InChI=1S/C22H16N4O5S/c1-12-7-9-14(10-8-12)26-20(30)16(11-15-17(27)23-21(31)24-18(15)28)19(29)25(22(26)32)13-5-3-2-4-6-13/h2-11,30H,1H3,(H2,23,24,27,28,31)