tert-butyl 4-[2-(4-fluorophenyl)-4-(2-morpholin-4-ylethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(4-fluorophenyl)-4-(2-morpholin-4-ylethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-fluorophenyl)-4-(2-morpholinoethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-(4-fluorophenyl)-4-[[2-(4-morpholinyl)ethylamino]-oxomethyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-fluorophenyl)-4-(2-morpholin-4-ylethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[2-(4-fluorophenyl)-4-(2-morpholinoethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H36FN5O4 MolecularWeight: 501.593543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=C(C=C3)F)C(=O)NCCN4CCOCC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=C(C=C3)F)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C26H36FN5O4/c1-26(2,3)36-25(34)31-11-8-19(9-12-31)23-22(18-29-32(23)21-6-4-20(27)5-7-21)24(33)28-10-13-30-14-16-35-17-15-30/h4-7,18-19H,8-17H2,1-3H3,(H,28,33)