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

Systemtic Name: tert-butyl 4-[4-[(1-cyclopentylpyrrolidin-3-yl)methylcarbamoyl]-2-(3,4-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(1-cyclopentylpyrrolidin-3-yl)methylcarbamoyl]-2-(3,4-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(1-cyclopentyl-3-pyrrolidinyl)methylamino]-oxomethyl]-2-(3,4-dimethylphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(1-cyclopentylpyrrolidin-3-yl)methylcarbamoyl]-2-(3,4-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(1-cyclopentylpyrrolidin-3-yl)methylcarbamoyl]-2-(3,4-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C32H47N5O3 MolecularWeight: 549.74728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)NCC3CCN(C3)C4CCCC4)C5CCN(CC5)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)NCC3CCN(C3)C4CCCC4)C5CCN(CC5)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C32H47N5O3/c1-22-10-11-27(18-23(22)2)37-29(25-13-16-35(17-14-25)31(39)40-32(3,4)5)28(20-34-37)30(38)33-19-24-12-15-36(21-24)26-8-6-7-9-26/h10-11,18,20,24-26H,6-9,12-17,19,21H2,1-5H3,(H,33,38)