Molecule ID: 24849117

IUPAC Name: N-(2,6-dimethylphenyl)-5,6-dihydro-4H-1,3-thiazin-3-ium-2-amine

Description: The molecule is an organic cation that is the conjugate acid of xylazine, obtained by the protonation of the thiazine nitrogen. It is a conjugate acid of a xylazine.

SMILES: Cc1cccc(C)c1NC1=[NH+]CCCS1

SELFIES: [C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][=NH1+1][C][C][C][S][Ring1][=Branch1]

InChI: InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)/p+1

Molecular Properties:
- Polar Surface Area: 51.3 Ų
- LogP: 2.8