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

Systemtic Name: 5,5-dimethyl-2-[3-methyl-1-oxidanidyl-4,5-bis(oxidanyl)imidazolidin-1-ium-1-yl]-4,6-dihydro-1,3-benzothiazol-7-one Openeye Name: 2-(4,5-dihydroxy-3-methyl-1-oxido-imidazolidin-1-ium-1-yl)-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one CAS Name: 2-(4,5-dihydroxy-3-methyl-1-oxido-1-imidazolidin-1-iumyl)-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one IUPAC Name: 2-(4,5-dihydroxy-3-methyl-1-oxidoimidazolidin-1-ium-1-yl)-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one Traditional Name: 2-(4,5-dihydroxy-3-methyl-1-oxido-imidazolidin-1-ium-1-yl)-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)SC(=N2)[N+]3(CN(C(C3O)O)C)[O-])C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)SC(=N2)[N+]3(CN(C(C3O)O)C)[O-])C

InChI

InChI=1S/C13H19N3O4S/c1-13(2)4-7-9(8(17)5-13)21-12(14-7)16(20)6-15(3)10(18)11(16)19/h10-11,18-19H,4-6H2,1-3H3