tert-butyl 4-[[[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]carbonylamino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]carbonylamino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[[5-tert-butyl-2-(p-tolyl)pyrazole-3-carbonyl]amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-oxomethyl]amino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[[5-tert-butyl-2-(4-methylphenyl)pyrazole-3-carbonyl]amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[5-tert-butyl-2-(p-tolyl)pyrazole-3-carbonyl]amino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H38N4O3 MolecularWeight: 454.60492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)C(=O)NCC3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)C(=O)NCC3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H38N4O3/c1-18-8-10-20(11-9-18)30-21(16-22(28-30)25(2,3)4)23(31)27-17-19-12-14-29(15-13-19)24(32)33-26(5,6)7/h8-11,16,19H,12-15,17H2,1-7H3,(H,27,31)