2-(3,3-dimethylbutylsulfanyl)-5-(trifluoromethyl)aniline

Systemtic Name: 2-(3,3-dimethylbutylsulfanyl)-5-(trifluoromethyl)aniline Openeye Name: 2-(3,3-dimethylbutylsulfanyl)-5-(trifluoromethyl)aniline CAS Name: 2-(3,3-dimethylbutylthio)-5-(trifluoromethyl)aniline IUPAC Name: 2-(3,3-dimethylbutylsulfanyl)-5-(trifluoromethyl)aniline Traditional Name: [2-(3,3-dimethylbutylthio)-5-(trifluoromethyl)phenyl]amine Formula: C13H18F3NS MolecularWeight: 277.34893

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18F3NS/c1-12(2,3)6-7-18-11-5-4-9(8-10(11)17)13(14,15)16/h4-5,8H,6-7,17H2,1-3H3