2-methyl-1,3-benzothiazole-6-sulfinic acid

Systemtic Name: 2-methyl-1,3-benzothiazole-6-sulfinic acid Openeye Name: 2-methyl-1,3-benzothiazole-6-sulfinic acid CAS Name: 2-methyl-1,3-benzothiazole-6-sulfinic acid IUPAC Name: 2-methyl-1,3-benzothiazole-6-sulfinic acid Traditional Name: 2-methyl-1,3-benzothiazole-6-sulfinic acid Formula: C8H7NO2S2 MolecularWeight: 213.27668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)O

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)O

InChI

InChI=1S/C8H7NO2S2/c1-5-9-7-3-2-6(13(10)11)4-8(7)12-5/h2-4H,1H3,(H,10,11)