5-methyl-4-nitro-1,2-thiazol-2-ium

Systemtic Name: 5-methyl-4-nitro-1,2-thiazol-2-ium Openeye Name: 5-methyl-4-nitro-isothiazol-2-ium CAS Name: 5-methyl-4-nitroisothiazol-2-ium IUPAC Name: 5-methyl-4-nitro-1,2-thiazol-2-ium Traditional Name: 5-methyl-4-nitro-isothiazol-2-ium Formula: C4H5N2O2S+ MolecularWeight: 145.1597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=[NH+]S1)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=[NH+]S1)[N+](=O)[O-]

InChI

InChI=1S/C4H4N2O2S/c1-3-4(6(7)8)2-5-9-3/h2H,1H3/p+1