3-(6-methylimidazo[2,1-b][1,3]thiazol-4-ium-7-yl)propane-1-sulfonate

Systemtic Name: 3-(6-methylimidazo[2,1-b][1,3]thiazol-4-ium-7-yl)propane-1-sulfonate Openeye Name: 3-(6-methylimidazo[2,1-b]thiazol-4-ium-7-yl)propane-1-sulfonate CAS Name: 3-(6-methyl-7-imidazo[2,1-b]thiazol-4-iumyl)-1-propanesulfonate IUPAC Name: 3-(6-methylimidazo[2,1-b][1,3]thiazol-4-ium-7-yl)propane-1-sulfonate Traditional Name: 3-(6-methylimidazo[2,1-b]thiazol-4-ium-7-yl)propane-1-sulfonate Formula: C9H12N2O3S2 MolecularWeight: 260.33318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(N1CCCS(=O)(=O)[O-])SC=C2

Isomeric SMILES

CC1=C[N+]2=C(N1CCCS(=O)(=O)[O-])SC=C2

InChI

InChI=1S/C9H12N2O3S2/c1-8-7-10-4-5-15-9(10)11(8)3-2-6-16(12,13)14/h4-5,7H,2-3,6H2,1H3