5-methyl-2-[3-methyl-1-oxidanidyl-4,5-bis(oxidanyl)imidazolidin-1-ium-1-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one

Systemtic Name: 5-methyl-2-[3-methyl-1-oxidanidyl-4,5-bis(oxidanyl)imidazolidin-1-ium-1-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Openeye Name: 2-(4,5-dihydroxy-3-methyl-1-oxido-imidazolidin-1-ium-1-yl)-5-methyl-5,6-dihydro-4H-1,3-benzothiazol-7-one CAS Name: 2-(4,5-dihydroxy-3-methyl-1-oxido-1-imidazolidin-1-iumyl)-5-methyl-5,6-dihydro-4H-1,3-benzothiazol-7-one IUPAC Name: 2-(4,5-dihydroxy-3-methyl-1-oxidoimidazolidin-1-ium-1-yl)-5-methyl-5,6-dihydro-4H-1,3-benzothiazol-7-one Traditional Name: 2-(4,5-dihydroxy-3-methyl-1-oxido-imidazolidin-1-ium-1-yl)-5-methyl-5,6-dihydro-4H-1,3-benzothiazol-7-one Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(=O)C1)SC(=N2)[N+]3(CN(C(C3O)O)C)[O-]

Isomeric SMILES

CC1CC2=C(C(=O)C1)SC(=N2)[N+]3(CN(C(C3O)O)C)[O-]

InChI

InChI=1S/C12H17N3O4S/c1-6-3-7-9(8(16)4-6)20-12(13-7)15(19)5-14(2)10(17)11(15)18/h6,10-11,17-18H,3-5H2,1-2H3