tert-butyl 4-[2-phenyl-4-(pyridin-2-ylmethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-phenyl-4-(pyridin-2-ylmethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-phenyl-4-(2-pyridylmethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[oxo-(2-pyridinylmethylamino)methyl]-2-phenyl-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-phenyl-4-(pyridin-2-ylmethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[2-phenyl-4-(2-pyridylmethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=CC=C3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=CC=C3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C26H31N5O3/c1-26(2,3)34-25(33)30-15-12-19(13-16-30)23-22(18-29-31(23)21-10-5-4-6-11-21)24(32)28-17-20-9-7-8-14-27-20/h4-11,14,18-19H,12-13,15-17H2,1-3H3,(H,28,32)