5-[2-ethanoyl-3-(4-hydroxyphenyl)-3,4-dihydropyrazol-5-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[2-ethanoyl-3-(4-hydroxyphenyl)-3,4-dihydropyrazol-5-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[2-acetyl-3-(4-hydroxyphenyl)-3,4-dihydropyrazol-5-yl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[2-acetyl-3-(4-hydroxyphenyl)-3,4-dihydropyrazol-5-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[2-acetyl-3-(4-hydroxyphenyl)-3,4-dihydropyrazol-5-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[1-acetyl-5-(4-hydroxyphenyl)-2-pyrazolin-3-yl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H14N4O4S MolecularWeight: 346.36106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C2C(=O)NC(=S)NC2=O)C3=CC=C(C=C3)O

Isomeric SMILES

CC(=O)N1C(CC(=N1)C2C(=O)NC(=S)NC2=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C15H14N4O4S/c1-7(20)19-11(8-2-4-9(21)5-3-8)6-10(18-19)12-13(22)16-15(24)17-14(12)23/h2-5,11-12,21H,6H2,1H3,(H2,16,17,22,23,24)