2-azanyl-5-[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]hexane-1,3-diol

Systemtic Name: 2-azanyl-5-[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]hexane-1,3-diol Openeye Name: 2-amino-5-[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]hexane-1,3-diol CAS Name: 2-amino-5-[4-[[3-(trifluoromethyl)phenyl]thio]phenyl]hexane-1,3-diol IUPAC Name: 2-amino-5-[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]hexane-1,3-diol Traditional Name: 2-amino-5-[4-[[3-(trifluoromethyl)phenyl]thio]phenyl]hexane-1,3-diol Formula: C19H22F3NO2S MolecularWeight: 385.44369

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(CO)N)O)C1=CC=C(C=C1)SC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(CC(C(CO)N)O)C1=CC=C(C=C1)SC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C19H22F3NO2S/c1-12(9-18(25)17(23)11-24)13-5-7-15(8-6-13)26-16-4-2-3-14(10-16)19(20,21)22/h2-8,10,12,17-18,24-25H,9,11,23H2,1H3