1-[[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]-2-methyl-propane-2-thiol

Systemtic Name: 1-[[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]-2-methyl-propane-2-thiol Openeye Name: 1-[[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]-2-methyl-propane-2-thiol CAS Name: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]amino]-2-methyl-2-propanethiol IUPAC Name: 1-[[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]-2-methylpropane-2-thiol Traditional Name: 1-[[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]-2-methyl-propane-2-thiol Formula: C10H13ClF3N2S+ MolecularWeight: 285.73683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(C=C(C=[NH+]1)C(F)(F)F)Cl)S

Isomeric SMILES

CC(C)(CNC1=C(C=C(C=[NH+]1)C(F)(F)F)Cl)S

InChI

InChI=1S/C10H12ClF3N2S/c1-9(2,17)5-16-8-7(11)3-6(4-15-8)10(12,13)14/h3-4,17H,5H2,1-2H3,(H,15,16)/p+1