1-(2-methylbut-3-yn-2-yl)-3-(5-methylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-imidazolidin-3-ium-4-ol

Systemtic Name: 1-(2-methylbut-3-yn-2-yl)-3-(5-methylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-imidazolidin-3-ium-4-ol Openeye Name: 1-(1,1-dimethylprop-2-ynyl)-3-(5-methylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol CAS Name: 1-(2-methylbut-3-yn-2-yl)-3-(5-methylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxido-4-imidazolidin-3-iumol IUPAC Name: 1-(2-methylbut-3-yn-2-yl)-3-(5-methylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxidoimidazolidin-3-ium-4-ol Traditional Name: 1-(1,1-dimethylprop-2-ynyl)-3-(5-mesyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol Formula: C11H16N4O4S2 MolecularWeight: 332.39914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)N1CC([N+](C1)(C2=NN=C(S2)S(=O)(=O)C)[O-])O

Isomeric SMILES

CC(C)(C#C)N1CC([N+](C1)(C2=NN=C(S2)S(=O)(=O)C)[O-])O

InChI

InChI=1S/C11H16N4O4S2/c1-5-11(2,3)14-6-8(16)15(17,7-14)9-12-13-10(20-9)21(4,18)19/h1,8,16H,6-7H2,2-4H3