2-(2-methyl-4-methylsulfanyl-pyridin-1-ium-1-yl)ethanol

Systemtic Name: 2-(2-methyl-4-methylsulfanyl-pyridin-1-ium-1-yl)ethanol Openeye Name: 2-(2-methyl-4-methylsulfanyl-pyridin-1-ium-1-yl)ethanol CAS Name: 2-[2-methyl-4-(methylthio)-1-pyridin-1-iumyl]ethanol IUPAC Name: 2-(2-methyl-4-methylsulfanylpyridin-1-ium-1-yl)ethanol Traditional Name: 2-[2-methyl-4-(methylthio)pyridin-1-ium-1-yl]ethanol Formula: C9H14NOS+ MolecularWeight: 184.27856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CC(=C1)SC)CCO

Isomeric SMILES

CC1=[N+](C=CC(=C1)SC)CCO

InChI

InChI=1S/C9H14NOS/c1-8-7-9(12-2)3-4-10(8)5-6-11/h3-4,7,11H,5-6H2,1-2H3/q+1