N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]isonipecotamide Formula: C25H29FN4O3S MolecularWeight: 484.586163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H29FN4O3S/c1-25(2,3)22-17-23(30(28-22)20-11-9-19(26)10-12-20)27-24(31)18-13-15-29(16-14-18)34(32,33)21-7-5-4-6-8-21/h4-12,17-18H,13-16H2,1-3H3,(H,27,31)