ethyl 2-azanyl-4-(4-chlorophenyl)-5-cyano-1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(4-chlorophenyl)-5-cyano-1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: ethyl 2-amino-4-(4-chlorophenyl)-5-cyano-1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-6-oxo-pyridine-3-carboxylate CAS Name: 2-amino-4-(4-chlorophenyl)-5-cyano-1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-6-oxo-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(4-chlorophenyl)-5-cyano-1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-6-oxopyridine-3-carboxylate Traditional Name: 2-amino-4-(4-chlorophenyl)-5-cyano-6-keto-1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)nicotinic acid ethyl ester Formula: C26H22ClN5O4 MolecularWeight: 503.93698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)C(=C1C2=CC=C(C=C2)Cl)C#N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)N

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)C(=C1C2=CC=C(C=C2)Cl)C#N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)N

InChI

InChI=1S/C26H22ClN5O4/c1-4-36-26(35)21-20(16-10-12-17(27)13-11-16)19(14-28)24(33)31(23(21)29)22-15(2)30(3)32(25(22)34)18-8-6-5-7-9-18/h5-13H,4,29H2,1-3H3