ethyl 4-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(2,4-dimethylphenyl)-5-phenyl-3-pyrazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2,4-dimethylphenyl)-5-phenylpyrazole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H28N4O3 MolecularWeight: 432.51482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=C(C=C(C=C3)C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=C(C=C(C=C3)C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O3/c1-4-32-25(31)28-14-12-27(13-15-28)24(30)23-17-21(20-8-6-5-7-9-20)26-29(23)22-11-10-18(2)16-19(22)3/h5-11,16-17H,4,12-15H2,1-3H3