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

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-(2-cyanophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-(2-cyanophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(2-cyanophenyl)sulfonyl-isonipecotamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C23H27N3O4S/c1-23(2,3)18-8-9-20(27)19(14-18)25-22(28)16-10-12-26(13-11-16)31(29,30)21-7-5-4-6-17(21)15-24/h4-9,14,16,27H,10-13H2,1-3H3,(H,25,28)