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

Systemtic Name: 1-(4-methoxyphenyl)-5-[(3-methyl-5-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(4-methoxyphenyl)-5-[(3-methyl-5-oxo-2-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(4-methoxyphenyl)-5-[(3-methyl-5-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(4-methoxyphenyl)-5-[(3-methyl-5-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(3-keto-5-methyl-1-phenyl-3-pyrazolin-4-yl)methylene]-1-(4-methoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1C2=CC=CC=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(=O)NN1C2=CC=CC=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H18N4O4S/c1-13-17(20(28)24-26(13)15-6-4-3-5-7-15)12-18-19(27)23-22(31)25(21(18)29)14-8-10-16(30-2)11-9-14/h3-12H,1-2H3,(H,24,28)(H,23,27,31)