N-(5-tert-butyl-2-oxidanyl-phenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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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=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H27N3O4S/c1-21(2,3)16-6-7-19(25)18(13-16)23-20(26)15-8-11-24(12-9-15)29(27,28)17-5-4-10-22-14-17/h4-7,10,13-15,25H,8-9,11-12H2,1-3H3,(H,23,26)