2-[(3,5-dimethylphenyl)methylsulfanyl]-5-(trifluoromethyl)aniline

Systemtic Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-5-(trifluoromethyl)aniline Openeye Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-5-(trifluoromethyl)aniline CAS Name: 2-[(3,5-dimethylphenyl)methylthio]-5-(trifluoromethyl)aniline IUPAC Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-5-(trifluoromethyl)aniline Traditional Name: [2-[(3,5-dimethylbenzyl)thio]-5-(trifluoromethyl)phenyl]amine Formula: C16H16F3NS MolecularWeight: 311.36515

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSC2=C(C=C(C=C2)C(F)(F)F)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSC2=C(C=C(C=C2)C(F)(F)F)N)C

InChI

InChI=1S/C16H16F3NS/c1-10-5-11(2)7-12(6-10)9-21-15-4-3-13(8-14(15)20)16(17,18)19/h3-8H,9,20H2,1-2H3