ethyl 2,4-bis(4-nitrophenyl)-5-thiophen-2-yl-pyrazole-3-carboxylate

Systemtic Name: ethyl 2,4-bis(4-nitrophenyl)-5-thiophen-2-yl-pyrazole-3-carboxylate Openeye Name: ethyl 2,4-bis(4-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxylate CAS Name: 2,4-bis(4-nitrophenyl)-5-thiophen-2-yl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,4-bis(4-nitrophenyl)-5-thiophen-2-ylpyrazole-3-carboxylate Traditional Name: 2,4-bis(4-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxylic acid ethyl ester Formula: C22H16N4O6S MolecularWeight: 464.45064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O6S/c1-2-32-22(27)21-19(14-5-7-16(8-6-14)25(28)29)20(18-4-3-13-33-18)23-24(21)15-9-11-17(12-10-15)26(30)31/h3-13H,2H2,1H3