4-[[3-(2-methylsulfanylphenyl)-5-(trifluoromethyl)phenyl]methoxymethyl]-4-phenyl-piperidine

Systemtic Name: 4-[[3-(2-methylsulfanylphenyl)-5-(trifluoromethyl)phenyl]methoxymethyl]-4-phenyl-piperidine Openeye Name: 4-[[3-(2-methylsulfanylphenyl)-5-(trifluoromethyl)phenyl]methoxymethyl]-4-phenyl-piperidine CAS Name: 4-[[3-[2-(methylthio)phenyl]-5-(trifluoromethyl)phenyl]methoxymethyl]-4-phenylpiperidine IUPAC Name: 4-[[3-(2-methylsulfanylphenyl)-5-(trifluoromethyl)phenyl]methoxymethyl]-4-phenylpiperidine Traditional Name: 4-[[3-[2-(methylthio)phenyl]-5-(trifluoromethyl)benzyl]oxymethyl]-4-phenyl-piperidine Formula: C27H28F3NOS MolecularWeight: 471.57753

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C2=CC(=CC(=C2)C(F)(F)F)COCC3(CCNCC3)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC=C1C2=CC(=CC(=C2)C(F)(F)F)COCC3(CCNCC3)C4=CC=CC=C4

InChI

InChI=1S/C27H28F3NOS/c1-33-25-10-6-5-9-24(25)21-15-20(16-23(17-21)27(28,29)30)18-32-19-26(11-13-31-14-12-26)22-7-3-2-4-8-22/h2-10,15-17,31H,11-14,18-19H2,1H3