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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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