N,N-dimethyl-N'-(2-methylpyridin-1-ium-1-yl)carbamimidothioate

Systemtic Name: N,N-dimethyl-N'-(2-methylpyridin-1-ium-1-yl)carbamimidothioate Openeye Name: N,N-dimethyl-N'-(2-methylpyridin-1-ium-1-yl)carbamimidothioate CAS Name: N,N-dimethyl-N'-(2-methyl-1-pyridin-1-iumyl)carbamimidothioate IUPAC Name: N,N-dimethyl-N'-(2-methylpyridin-1-ium-1-yl)carbamimidothioate Traditional Name: N,N-dimethyl-N'-(2-methylpyridin-1-ium-1-yl)carbamimidothioate Formula: C9H13N3S MolecularWeight: 195.28462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1N=C(N(C)C)[S-]

Isomeric SMILES

CC1=CC=CC=[N+]1/N=C(/N(C)C)\[S-]

InChI

InChI=1S/C9H13N3S/c1-8-6-4-5-7-12(8)10-9(13)11(2)3/h4-7H,1-3H3