tert-butyl 4-[4-(cyclopentylcarbamoyl)-2-(2,6-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(cyclopentylcarbamoyl)-2-(2,6-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(cyclopentylcarbamoyl)-2-(2,6-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(cyclopentylamino)-oxomethyl]-2-(2,6-dimethylphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(cyclopentylcarbamoyl)-2-(2,6-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(cyclopentylcarbamoyl)-2-(2,6-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H38N4O3 MolecularWeight: 466.61562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=C(C=N2)C(=O)NC3CCCC3)C4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=C(C=N2)C(=O)NC3CCCC3)C4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H38N4O3/c1-18-9-8-10-19(2)23(18)31-24(22(17-28-31)25(32)29-21-11-6-7-12-21)20-13-15-30(16-14-20)26(33)34-27(3,4)5/h8-10,17,20-21H,6-7,11-16H2,1-5H3,(H,29,32)