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

Systemtic Name: tert-butyl 4-[4-(cyclopropylcarbamoyl)-2-(2,4-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(cyclopropylcarbamoyl)-2-(2,4-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(cyclopropylamino)-oxomethyl]-2-(2,4-dimethylphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(cyclopropylcarbamoyl)-2-(2,4-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(cyclopropylcarbamoyl)-2-(2,4-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C(C=N2)C(=O)NC3CC3)C4CCN(CC4)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C(C=N2)C(=O)NC3CC3)C4CCN(CC4)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C25H34N4O3/c1-16-6-9-21(17(2)14-16)29-22(20(15-26-29)23(30)27-19-7-8-19)18-10-12-28(13-11-18)24(31)32-25(3,4)5/h6,9,14-15,18-19H,7-8,10-13H2,1-5H3,(H,27,30)