ethyl 4-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[3-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(3,4-dimethylphenyl)-1-phenylpyrazole-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CN(N=C2C3=CC(=C(C=C3)C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CN(N=C2C3=CC(=C(C=C3)C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O3/c1-4-33-26(32)29-14-12-21(13-15-29)27-25(31)23-17-30(22-8-6-5-7-9-22)28-24(23)20-11-10-18(2)19(3)16-20/h5-11,16-17,21H,4,12-15H2,1-3H3,(H,27,31)