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

Systemtic Name: (5E)-1-(3-ethoxyphenyl)-5-[[(4S)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-1-(3-ethoxyphenyl)-5-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-1-(3-ethoxyphenyl)-5-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-1-(3-ethoxyphenyl)-5-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-6-keto-5-[[(4S)-5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl]methylene]-1-m-phenetyl-2-thioxo-pyrimidin-4-olate Formula: C23H19N4O4S- MolecularWeight: 447.48636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)N2C(=O)C(=CC3C(=NN(C3=O)C4=CC=CC=C4)C)C(=NC2=S)[O-]

Isomeric SMILES

CCOC1=CC=CC(=C1)N2C(=O)/C(=C/[C@H]3C(=NN(C3=O)C4=CC=CC=C4)C)/C(=NC2=S)[O-]

InChI

InChI=1S/C23H20N4O4S/c1-3-31-17-11-7-10-16(12-17)26-21(29)19(20(28)24-23(26)32)13-18-14(2)25-27(22(18)30)15-8-5-4-6-9-15/h4-13,18H,3H2,1-2H3,(H,24,28,32)/p-1/b19-13+/t18-/m0/s1