4-phenyl-4-[[3-thianthren-1-yl-5-(trifluoromethyl)phenyl]methoxymethyl]piperidine

Systemtic Name: 4-phenyl-4-[[3-thianthren-1-yl-5-(trifluoromethyl)phenyl]methoxymethyl]piperidine Openeye Name: 4-phenyl-4-[[3-thianthren-1-yl-5-(trifluoromethyl)phenyl]methoxymethyl]piperidine CAS Name: 4-phenyl-4-[[3-(1-thianthrenyl)-5-(trifluoromethyl)phenyl]methoxymethyl]piperidine IUPAC Name: 4-phenyl-4-[[3-thianthren-1-yl-5-(trifluoromethyl)phenyl]methoxymethyl]piperidine Traditional Name: 4-phenyl-4-[[3-thianthren-1-yl-5-(trifluoromethyl)benzyl]oxymethyl]piperidine Formula: C32H28F3NOS2 MolecularWeight: 563.69603

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(COCC2=CC(=CC(=C2)C3=C4C(=CC=C3)SC5=CC=CC=C5S4)C(F)(F)F)C6=CC=CC=C6

Isomeric SMILES

C1CNCCC1(COCC2=CC(=CC(=C2)C3=C4C(=CC=C3)SC5=CC=CC=C5S4)C(F)(F)F)C6=CC=CC=C6

InChI

InChI=1S/C32H28F3NOS2/c33-32(34,35)25-18-22(20-37-21-31(13-15-36-16-14-31)24-7-2-1-3-8-24)17-23(19-25)26-9-6-12-29-30(26)39-28-11-5-4-10-27(28)38-29/h1-12,17-19,36H,13-16,20-21H2