[3-(5-bromanyl-1,3-thiazol-2-yl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-yl] 3,4-bis(bromanyl)furan-2-carboxylate

Systemtic Name: [3-(5-bromanyl-1,3-thiazol-2-yl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-yl] 3,4-bis(bromanyl)furan-2-carboxylate Openeye Name: [3-(5-bromothiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl] 3,4-dibromofuran-2-carboxylate CAS Name: 3,4-dibromo-2-furancarboxylic acid [3-(5-bromo-2-thiazolyl)-1-methyl-3-oxido-4-imidazolidin-3-iumyl] ester IUPAC Name: [3-(5-bromo-1,3-thiazol-2-yl)-1-methyl-3-oxidoimidazolidin-3-ium-4-yl] 3,4-dibromofuran-2-carboxylate Traditional Name: 3,4-dibromofuran-2-carboxylic acid [3-(5-bromothiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl] ester Formula: C12H10Br3N3O4S MolecularWeight: 532.0025

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC([N+](C1)(C2=NC=C(S2)Br)[O-])OC(=O)C3=C(C(=CO3)Br)Br

Isomeric SMILES

CN1CC([N+](C1)(C2=NC=C(S2)Br)[O-])OC(=O)C3=C(C(=CO3)Br)Br

InChI

InChI=1S/C12H10Br3N3O4S/c1-17-3-8(18(20,5-17)12-16-2-7(14)23-12)22-11(19)10-9(15)6(13)4-21-10/h2,4,8H,3,5H2,1H3