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

Systemtic Name: 5-[[2-(4-methoxyphenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[2-(4-methoxyphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[2-(4-methoxyphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[2-(4-methoxyphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[5-keto-1-(4-methoxyphenyl)-3-methyl-3-pyrazolin-4-yl]methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C28H22N4O4S MolecularWeight: 510.56368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)OC)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)OC)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H22N4O4S/c1-18-23(27(35)32(29-18)21-13-15-22(36-2)16-14-21)17-24-25(33)30(19-9-5-3-6-10-19)28(37)31(26(24)34)20-11-7-4-8-12-20/h3-17,29H,1-2H3