4-azanyl-6-(trifluoromethyl)-1H-pyrimidine-2-thione; methanesulfonate

Systemtic Name: 4-azanyl-6-(trifluoromethyl)-1H-pyrimidine-2-thione; methanesulfonate Openeye Name: 4-amino-6-(trifluoromethyl)-1H-pyrimidine-2-thione; methanesulfonate CAS Name: 4-amino-6-(trifluoromethyl)-1H-pyrimidine-2-thione; methanesulfonate IUPAC Name: 4-amino-6-(trifluoromethyl)-1H-pyrimidine-2-thione; methanesulfonate Traditional Name: 4-amino-6-(trifluoromethyl)-1H-pyrimidine-2-thione mesylate Formula: C6H7F3N3O3S2- MolecularWeight: 290.26329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=C(NC(=S)N=C1N)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)[O-].C1=C(NC(=S)N=C1N)C(F)(F)F

InChI

InChI=1S/C5H4F3N3S.CH4O3S/c6-5(7,8)2-1-3(9)11-4(12)10-2;1-5(2,3)4/h1H,(H3,9,10,11,12);1H3,(H,2,3,4)/p-1