(5Z)-5-[[(4R)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylidene]-1-(4-methylphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-5-[[(4R)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylidene]-1-(4-methylphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylene]-6-oxo-1-(p-tolyl)-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-1-(4-methylphenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-1-(4-methylphenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-6-keto-5-[[(4R)-5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl]methylene]-1-(p-tolyl)-2-thioxo-pyrimidin-4-olate Formula: C22H17N4O3S- MolecularWeight: 417.46038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3C(=NN(C3=O)C4=CC=CC=C4)C)C(=NC2=S)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C\[C@@H]3C(=NN(C3=O)C4=CC=CC=C4)C)/C(=NC2=S)[O-]

InChI

InChI=1S/C22H18N4O3S/c1-13-8-10-15(11-9-13)25-20(28)18(19(27)23-22(25)30)12-17-14(2)24-26(21(17)29)16-6-4-3-5-7-16/h3-12,17H,1-2H3,(H,23,27,30)/p-1/b18-12-/t17-/m1/s1