[4-fluoranyl-3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]phenyl]methanamine

Systemtic Name: [4-fluoranyl-3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]phenyl]methanamine Openeye Name: [4-fluoro-3-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]phenyl]methanamine CAS Name: [4-fluoro-3-[[[5-(trifluoromethyl)-2-pyridinyl]thio]methyl]phenyl]methanamine IUPAC Name: [4-fluoro-3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]phenyl]methanamine Traditional Name: [4-fluoro-3-[[[5-(trifluoromethyl)-2-pyridyl]thio]methyl]benzyl]amine Formula: C14H12F4N2S MolecularWeight: 316.317093

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN)CSC2=NC=C(C=C2)C(F)(F)F)F

Isomeric SMILES

C1=CC(=C(C=C1CN)CSC2=NC=C(C=C2)C(F)(F)F)F

InChI

InChI=1S/C14H12F4N2S/c15-12-3-1-9(6-19)5-10(12)8-21-13-4-2-11(7-20-13)14(16,17)18/h1-5,7H,6,8,19H2