ethyl (2S)-2-cyano-2-[(4R)-3-methyl-4-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-5-oxidanylidene-1-phenyl-pyrazol-4-yl]ethanoate

Systemtic Name: ethyl (2S)-2-cyano-2-[(4R)-3-methyl-4-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-5-oxidanylidene-1-phenyl-pyrazol-4-yl]ethanoate Openeye Name: ethyl (2S)-2-cyano-2-[(4R)-3-methyl-4-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-oxo-1-phenyl-pyrazol-4-yl]acetate CAS Name: (2S)-2-cyano-2-[(4R)-3-methyl-4-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-oxo-1-phenyl-4-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-2-[(4R)-3-methyl-4-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-oxo-1-phenylpyrazol-4-yl]acetate Traditional Name: (2S)-2-cyano-2-[(4R)-5-keto-4-(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)-3-methyl-1-phenyl-2-pyrazolin-4-yl]acetic acid ethyl ester Formula: C25H23N5O4 MolecularWeight: 457.48122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)[C@H](C#N)[C@]1(C(=NN(C1=O)C2=CC=CC=C2)C)C3=C(NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H23N5O4/c1-4-34-23(32)20(15-26)25(17(3)28-30(24(25)33)19-13-9-6-10-14-19)21-16(2)27-29(22(21)31)18-11-7-5-8-12-18/h5-14,20,27H,4H2,1-3H3/t20-,25+/m0/s1