(4-azanyl-1-methyl-2-sulfanylidene-pyrimidin-5-yl)methanesulfonic acid

Systemtic Name: (4-azanyl-1-methyl-2-sulfanylidene-pyrimidin-5-yl)methanesulfonic acid Openeye Name: (4-amino-1-methyl-2-thioxo-pyrimidin-5-yl)methanesulfonic acid CAS Name: (4-amino-1-methyl-2-sulfanylidene-5-pyrimidinyl)methanesulfonic acid IUPAC Name: (4-amino-1-methyl-2-sulfanylidenepyrimidin-5-yl)methanesulfonic acid Traditional Name: (4-amino-1-methyl-2-thioxo-pyrimidin-5-yl)methanesulfonic acid Formula: C6H9N3O3S2 MolecularWeight: 235.28396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=NC1=S)N)CS(=O)(=O)O

Isomeric SMILES

CN1C=C(C(=NC1=S)N)CS(=O)(=O)O

InChI

InChI=1S/C6H9N3O3S2/c1-9-2-4(3-14(10,11)12)5(7)8-6(9)13/h2H,3H2,1H3,(H2,7,8,13)(H,10,11,12)