[4-butan-2-ylsulfanyl-2-(trifluoromethyl)phenyl]methanamine

Systemtic Name: [4-butan-2-ylsulfanyl-2-(trifluoromethyl)phenyl]methanamine Openeye Name: [4-sec-butylsulfanyl-2-(trifluoromethyl)phenyl]methanamine CAS Name: [4-(butan-2-ylthio)-2-(trifluoromethyl)phenyl]methanamine IUPAC Name: [4-butan-2-ylsulfanyl-2-(trifluoromethyl)phenyl]methanamine Traditional Name: [4-(sec-butylthio)-2-(trifluoromethyl)benzyl]amine Formula: C12H16F3NS MolecularWeight: 263.32235

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC(=C(C=C1)CN)C(F)(F)F

Isomeric SMILES

CCC(C)SC1=CC(=C(C=C1)CN)C(F)(F)F

InChI

InChI=1S/C12H16F3NS/c1-3-8(2)17-10-5-4-9(7-16)11(6-10)12(13,14)15/h4-6,8H,3,7,16H2,1-2H3