ethyl 5-[[4-[(4-ethoxycarbonyl-2-phenyl-pyrazol-3-yl)amino]-4-oxidanylidene-butanoyl]amino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[4-[(4-ethoxycarbonyl-2-phenyl-pyrazol-3-yl)amino]-4-oxidanylidene-butanoyl]amino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[4-[(4-ethoxycarbonyl-2-phenyl-pyrazol-3-yl)amino]-4-oxo-butanoyl]amino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[4-[(4-ethoxycarbonyl-2-phenyl-3-pyrazolyl)amino]-1,4-dioxobutyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-[(4-ethoxycarbonyl-2-phenylpyrazol-3-yl)amino]-4-oxobutanoyl]amino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[[4-[(4-carbethoxy-2-phenyl-pyrazol-3-yl)amino]-4-keto-butanoyl]amino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C28H28N6O6 MolecularWeight: 544.55852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCC(=O)NC3=C(C=NN3C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCC(=O)NC3=C(C=NN3C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C28H28N6O6/c1-3-39-27(37)21-17-29-33(19-11-7-5-8-12-19)25(21)31-23(35)15-16-24(36)32-26-22(28(38)40-4-2)18-30-34(26)20-13-9-6-10-14-20/h5-14,17-18H,3-4,15-16H2,1-2H3,(H,31,35)(H,32,36)