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

Systemtic Name: (5Z)-1-methyl-5-[[(4R)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-1-methyl-5-[[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-1-methyl-5-[[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-1-methyl-5-[[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-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-methyl-2-thioxo-pyrimidin-4-olate Formula: C16H13N4O3S- MolecularWeight: 341.36442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C=C2C(=NC(=S)N(C2=O)C)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)[C@@H]1/C=C\2/C(=NC(=S)N(C2=O)C)[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H14N4O3S/c1-9-11(8-12-13(21)17-16(24)19(2)14(12)22)15(23)20(18-9)10-6-4-3-5-7-10/h3-8,11H,1-2H3,(H,17,21,24)/p-1/b12-8-/t11-/m1/s1