4-[4-chloranyl-3-(trifluoromethyl)phenyl]-1-[(2R)-2-oxidanyl-3-phenylsulfanyl-propyl]piperidin-4-ol

Systemtic Name: 4-[4-chloranyl-3-(trifluoromethyl)phenyl]-1-[(2R)-2-oxidanyl-3-phenylsulfanyl-propyl]piperidin-4-ol Openeye Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-1-[(2R)-2-hydroxy-3-phenylsulfanyl-propyl]piperidin-4-ol CAS Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-1-[(2R)-2-hydroxy-3-(phenylthio)propyl]-4-piperidinol IUPAC Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-1-[(2R)-2-hydroxy-3-phenylsulfanylpropyl]piperidin-4-ol Traditional Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-1-[(2R)-2-hydroxy-3-(phenylthio)propyl]piperidin-4-ol Formula: C21H23ClF3NO2S MolecularWeight: 445.92603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)CC(CSC3=CC=CC=C3)O

Isomeric SMILES

C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)C[C@H](CSC3=CC=CC=C3)O

InChI

InChI=1S/C21H23ClF3NO2S/c22-19-7-6-15(12-18(19)21(23,24)25)20(28)8-10-26(11-9-20)13-16(27)14-29-17-4-2-1-3-5-17/h1-7,12,16,27-28H,8-11,13-14H2/t16-/m1/s1