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

Systemtic Name: 5-[[2-(3,4-dimethylphenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[1-(3,4-dimethylphenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C29H24N4O3S MolecularWeight: 508.59086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=C(N2)C)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=C(N2)C)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C29H24N4O3S/c1-18-14-15-23(16-19(18)2)33-28(36)24(20(3)30-33)17-25-26(34)31(21-10-6-4-7-11-21)29(37)32(27(25)35)22-12-8-5-9-13-22/h4-17,30H,1-3H3