2-(pyridin-3-ylmethylsulfanyl)-3-(trifluoromethyl)aniline

Systemtic Name: 2-(pyridin-3-ylmethylsulfanyl)-3-(trifluoromethyl)aniline Openeye Name: 2-(3-pyridylmethylsulfanyl)-3-(trifluoromethyl)aniline CAS Name: 2-(3-pyridinylmethylthio)-3-(trifluoromethyl)aniline IUPAC Name: 2-(pyridin-3-ylmethylsulfanyl)-3-(trifluoromethyl)aniline Traditional Name: [2-(3-pyridylmethylthio)-3-(trifluoromethyl)phenyl]amine Formula: C13H11F3N2S MolecularWeight: 284.30005

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)N)SCC2=CN=CC=C2)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C(=C1)N)SCC2=CN=CC=C2)C(F)(F)F

InChI

InChI=1S/C13H11F3N2S/c14-13(15,16)10-4-1-5-11(17)12(10)19-8-9-3-2-6-18-7-9/h1-7H,8,17H2