ethyl 4-[(5-ethoxycarbonyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-thiophen-3-yl-methyl]-3-oxidanylidene-2-phenyl-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-[(5-ethoxycarbonyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-thiophen-3-yl-methyl]-3-oxidanylidene-2-phenyl-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-[(5-ethoxycarbonyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-(3-thienyl)methyl]-3-oxo-2-phenyl-1H-pyrazole-5-carboxylate CAS Name: 4-[(5-ethoxycarbonyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-(3-thiophenyl)methyl]-3-oxo-2-phenyl-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-ethoxycarbonyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-thiophen-3-ylmethyl]-3-oxo-2-phenyl-1H-pyrazole-5-carboxylate Traditional Name: 4-[(3-carbethoxy-5-keto-1-phenyl-3-pyrazolin-4-yl)-(3-thienyl)methyl]-5-keto-1-phenyl-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C29H26N4O6S MolecularWeight: 558.60494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CSC=C3)C4=C(NN(C4=O)C5=CC=CC=C5)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CSC=C3)C4=C(NN(C4=O)C5=CC=CC=C5)C(=O)OCC

InChI

InChI=1S/C29H26N4O6S/c1-3-38-28(36)24-22(26(34)32(30-24)19-11-7-5-8-12-19)21(18-15-16-40-17-18)23-25(29(37)39-4-2)31-33(27(23)35)20-13-9-6-10-14-20/h5-17,21,30-31H,3-4H2,1-2H3