2-phenyl-N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ethanamine

Systemtic Name: 2-phenyl-N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ethanamine Openeye Name: 2-phenyl-N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ethanamine CAS Name: 2-phenyl-N-[[4-(trifluoromethylthio)phenyl]methyl]ethanamine IUPAC Name: 2-phenyl-N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ethanamine Traditional Name: phenethyl-[4-(trifluoromethylthio)benzyl]amine Formula: C16H16F3NS MolecularWeight: 311.36515

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCC2=CC=C(C=C2)SC(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCNCC2=CC=C(C=C2)SC(F)(F)F

InChI

InChI=1S/C16H16F3NS/c17-16(18,19)21-15-8-6-14(7-9-15)12-20-11-10-13-4-2-1-3-5-13/h1-9,20H,10-12H2