1-tert-butyl-3-(hydroxymethyl)-3H-pyridin-1-ium-2-thione

Systemtic Name: 1-tert-butyl-3-(hydroxymethyl)-3H-pyridin-1-ium-2-thione Openeye Name: 1-tert-butyl-3-(hydroxymethyl)-3H-pyridin-1-ium-2-thione CAS Name: 1-tert-butyl-3-(hydroxymethyl)-3H-pyridin-1-ium-2-thione IUPAC Name: 1-tert-butyl-3-(hydroxymethyl)-3H-pyridin-1-ium-2-thione Traditional Name: 1-tert-butyl-3-methylol-3H-pyridin-1-ium-2-thione Formula: C10H16NOS+ MolecularWeight: 198.30514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+]1=CC=CC(C1=S)CO

Isomeric SMILES

CC(C)(C)[N+]1=CC=CC(C1=S)CO

InChI

InChI=1S/C10H16NOS/c1-10(2,3)11-6-4-5-8(7-12)9(11)13/h4-6,8,12H,7H2,1-3H3/q+1