3-[5,6-bis(chloranyl)-1,3-benzothiazol-2-yl]-2-(2-bromoethyl)-3-oxidanidyl-imidazolidin-3-ium-4-ol

Systemtic Name: 3-[5,6-bis(chloranyl)-1,3-benzothiazol-2-yl]-2-(2-bromoethyl)-3-oxidanidyl-imidazolidin-3-ium-4-ol Openeye Name: 2-(2-bromoethyl)-3-(5,6-dichloro-1,3-benzothiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol CAS Name: 2-(2-bromoethyl)-3-(5,6-dichloro-1,3-benzothiazol-2-yl)-3-oxido-4-imidazolidin-3-iumol IUPAC Name: 2-(2-bromoethyl)-3-(5,6-dichloro-1,3-benzothiazol-2-yl)-3-oxidoimidazolidin-3-ium-4-ol Traditional Name: 2-(2-bromoethyl)-3-(5,6-dichloro-1,3-benzothiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol Formula: C12H12BrCl2N3O2S MolecularWeight: 413.11758

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Descriptors Computed from Structure

Canonical SMILES:

C1C([N+](C(N1)CCBr)(C2=NC3=CC(=C(C=C3S2)Cl)Cl)[O-])O

Isomeric SMILES

C1C([N+](C(N1)CCBr)(C2=NC3=CC(=C(C=C3S2)Cl)Cl)[O-])O

InChI

InChI=1S/C12H12BrCl2N3O2S/c13-2-1-10-16-5-11(19)18(10,20)12-17-8-3-6(14)7(15)4-9(8)21-12/h3-4,10-11,16,19H,1-2,5H2