N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-1-(4-tert-butylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-1-(4-tert-butylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-N-[2-(difluoromethylsulfanyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(4-tert-butylphenyl)sulfonyl-N-[2-(difluoromethylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-N-[2-(difluoromethylsulfanyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-N-[2-(difluoromethylthio)phenyl]isonipecotamide Formula: C23H28F2N2O3S2 MolecularWeight: 482.606826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3SC(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3SC(F)F

InChI

InChI=1S/C23H28F2N2O3S2/c1-23(2,3)17-8-10-18(11-9-17)32(29,30)27-14-12-16(13-15-27)21(28)26-19-6-4-5-7-20(19)31-22(24)25/h4-11,16,22H,12-15H2,1-3H3,(H,26,28)