3-[7-(trifluoromethyl)quinolin-2-yl]sulfanylpropan-1-amine

Systemtic Name: 3-[7-(trifluoromethyl)quinolin-2-yl]sulfanylpropan-1-amine Openeye Name: 3-[[7-(trifluoromethyl)-2-quinolyl]sulfanyl]propan-1-amine CAS Name: 3-[[7-(trifluoromethyl)-2-quinolinyl]thio]-1-propanamine IUPAC Name: 3-[7-(trifluoromethyl)quinolin-2-yl]sulfanylpropan-1-amine Traditional Name: 3-[[7-(trifluoromethyl)-2-quinolyl]thio]propylamine Formula: C13H13F3N2S MolecularWeight: 286.31593

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC(=N2)SCCCN)C(F)(F)F

Isomeric SMILES

C1=CC(=CC2=C1C=CC(=N2)SCCCN)C(F)(F)F

InChI

InChI=1S/C13H13F3N2S/c14-13(15,16)10-4-2-9-3-5-12(18-11(9)8-10)19-7-1-6-17/h2-5,8H,1,6-7,17H2