N-tert-butyl-4-[3-(trifluoromethyl)phenyl]sulfanyl-aniline

Systemtic Name: N-tert-butyl-4-[3-(trifluoromethyl)phenyl]sulfanyl-aniline Openeye Name: N-tert-butyl-4-[3-(trifluoromethyl)phenyl]sulfanyl-aniline CAS Name: N-tert-butyl-4-[[3-(trifluoromethyl)phenyl]thio]aniline IUPAC Name: N-tert-butyl-4-[3-(trifluoromethyl)phenyl]sulfanylaniline Traditional Name: tert-butyl-[4-[[3-(trifluoromethyl)phenyl]thio]phenyl]amine Formula: C17H18F3NS MolecularWeight: 325.39173

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=CC=C(C=C1)SC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)NC1=CC=C(C=C1)SC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C17H18F3NS/c1-16(2,3)21-13-7-9-14(10-8-13)22-15-6-4-5-12(11-15)17(18,19)20/h4-11,21H,1-3H3