ethyl (4E)-5-oxidanylidene-4-[(4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)methylidene]-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl (4E)-5-oxidanylidene-4-[(4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)methylidene]-1-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl (4E)-5-oxo-4-[(4-oxo-2-thioxo-pyrimidin-1-yl)methylene]-1-phenyl-pyrazole-3-carboxylate CAS Name: (4E)-5-oxo-4-[(4-oxo-2-sulfanylidene-1-pyrimidinyl)methylidene]-1-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl (4E)-5-oxo-4-[(4-oxo-2-sulfanylidenepyrimidin-1-yl)methylidene]-1-phenylpyrazole-3-carboxylate Traditional Name: (4E)-5-keto-4-[(4-keto-2-thioxo-pyrimidin-1-yl)methylene]-1-phenyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1=CN2C=CC(=O)NC2=S)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C\1=NN(C(=O)/C1=C/N2C=CC(=O)NC2=S)C3=CC=CC=C3

InChI

InChI=1S/C17H14N4O4S/c1-2-25-16(24)14-12(10-20-9-8-13(22)18-17(20)26)15(23)21(19-14)11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H,18,22,26)/b12-10+