5-[[2-(4-methylphenyl)-3-oxidanyl-5-oxidanylidene-1H-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[2-(4-methylphenyl)-3-oxidanyl-5-oxidanylidene-1H-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[3-hydroxy-5-oxo-2-(p-tolyl)-1H-pyrazol-4-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[3-hydroxy-2-(4-methylphenyl)-5-oxo-1H-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[3-hydroxy-2-(4-methylphenyl)-5-oxo-1H-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[5-hydroxy-3-keto-1-(p-tolyl)-3-pyrazolin-4-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H12N4O4S MolecularWeight: 344.34518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=O)N2)C=C3C(=O)NC(=S)NC3=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=O)N2)C=C3C(=O)NC(=S)NC3=O)O

InChI

InChI=1S/C15H12N4O4S/c1-7-2-4-8(5-3-7)19-14(23)10(13(22)18-19)6-9-11(20)16-15(24)17-12(9)21/h2-6,23H,1H3,(H,18,22)(H2,16,17,20,21,24)