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

Systemtic Name: ethyl (4Z)-4-[[(5E)-5-[(3-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]methylidene]-5-oxidanylidene-1-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl (4Z)-4-[[(5E)-5-[(3-nitrophenyl)methylene]-4-oxo-2-thioxo-imidazolidin-1-yl]methylene]-5-oxo-1-phenyl-pyrazole-3-carboxylate CAS Name: (4Z)-4-[[(5E)-5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1-imidazolidinyl]methylidene]-5-oxo-1-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl (4Z)-4-[[(5E)-5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylideneimidazolidin-1-yl]methylidene]-5-oxo-1-phenylpyrazole-3-carboxylate Traditional Name: (4Z)-5-keto-4-[[(5E)-4-keto-5-(3-nitrobenzylidene)-2-thioxo-imidazolidin-1-yl]methylene]-1-phenyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C23H17N5O6S MolecularWeight: 491.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1=CN2C(=CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)NC2=S)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C\1=NN(C(=O)/C1=C\N2/C(=C/C3=CC(=CC=C3)[N+](=O)[O-])/C(=O)NC2=S)C4=CC=CC=C4

InChI

InChI=1S/C23H17N5O6S/c1-2-34-22(31)19-17(21(30)27(25-19)15-8-4-3-5-9-15)13-26-18(20(29)24-23(26)35)12-14-7-6-10-16(11-14)28(32)33/h3-13H,2H2,1H3,(H,24,29,35)/b17-13-,18-12+