1-[3-fluoranyl-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-phenyl]ethanamine

Systemtic Name: 1-[3-fluoranyl-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-phenyl]ethanamine Openeye Name: 1-[3-fluoro-4-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]phenyl]ethanamine CAS Name: 1-[3-fluoro-4-[[5-(trifluoromethyl)-2-pyridinyl]thio]phenyl]ethanamine IUPAC Name: 1-[3-fluoro-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylphenyl]ethanamine Traditional Name: 1-[3-fluoro-4-[[5-(trifluoromethyl)-2-pyridyl]thio]phenyl]ethylamine Formula: C14H12F4N2S MolecularWeight: 316.317093

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)SC2=NC=C(C=C2)C(F)(F)F)F)N

Isomeric SMILES

CC(C1=CC(=C(C=C1)SC2=NC=C(C=C2)C(F)(F)F)F)N

InChI

InChI=1S/C14H12F4N2S/c1-8(19)9-2-4-12(11(15)6-9)21-13-5-3-10(7-20-13)14(16,17)18/h2-8H,19H2,1H3