N-(5-tert-butyl-2-methoxy-phenyl)-1-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-1-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-1-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C24H28ClF3N2O4S MolecularWeight: 533.00333

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C24H28ClF3N2O4S/c1-23(2,3)16-6-8-20(34-4)19(13-16)29-22(31)15-9-11-30(12-10-15)35(32,33)21-14-17(24(26,27)28)5-7-18(21)25/h5-8,13-15H,9-12H2,1-4H3,(H,29,31)