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

Systemtic Name: N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ethanamine Openeye Name: N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ethanamine CAS Name: N-[[4-(trifluoromethylthio)phenyl]methyl]ethanamine IUPAC Name: N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ethanamine Traditional Name: ethyl-[4-(trifluoromethylthio)benzyl]amine Formula: C10H12F3NS MolecularWeight: 235.26919

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC=C(C=C1)SC(F)(F)F

Isomeric SMILES

CCNCC1=CC=C(C=C1)SC(F)(F)F

InChI

InChI=1S/C10H12F3NS/c1-2-14-7-8-3-5-9(6-4-8)15-10(11,12)13/h3-6,14H,2,7H2,1H3