2-(3-methylbutylsulfanyl)-5-(trifluoromethyl)aniline

Systemtic Name: 2-(3-methylbutylsulfanyl)-5-(trifluoromethyl)aniline Openeye Name: 2-isopentylsulfanyl-5-(trifluoromethyl)aniline CAS Name: 2-(3-methylbutylthio)-5-(trifluoromethyl)aniline IUPAC Name: 2-(3-methylbutylsulfanyl)-5-(trifluoromethyl)aniline Traditional Name: [2-(isoamylthio)-5-(trifluoromethyl)phenyl]amine Formula: C12H16F3NS MolecularWeight: 263.32235

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=C(C=C(C=C1)C(F)(F)F)N

Isomeric SMILES

CC(C)CCSC1=C(C=C(C=C1)C(F)(F)F)N

InChI

InChI=1S/C12H16F3NS/c1-8(2)5-6-17-11-4-3-9(7-10(11)16)12(13,14)15/h3-4,7-8H,5-6,16H2,1-2H3