N-(5-tert-butyl-2-oxidanyl-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C22H27FN2O4S MolecularWeight: 434.524183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H27FN2O4S/c1-22(2,3)16-6-11-20(26)19(13-16)24-21(27)15-5-4-12-25(14-15)30(28,29)18-9-7-17(23)8-10-18/h6-11,13,15,26H,4-5,12,14H2,1-3H3,(H,24,27)