[1-(5-hexylsulfonyl-1,3-thiazol-2-yl)-3-methyl-1-oxidanidyl-imidazolidin-1-ium-2-yl] ethanoate

Systemtic Name: [1-(5-hexylsulfonyl-1,3-thiazol-2-yl)-3-methyl-1-oxidanidyl-imidazolidin-1-ium-2-yl] ethanoate Openeye Name: [1-(5-hexylsulfonylthiazol-2-yl)-3-methyl-1-oxido-imidazolidin-1-ium-2-yl] acetate CAS Name: acetic acid [1-(5-hexylsulfonyl-2-thiazolyl)-3-methyl-1-oxido-2-imidazolidin-1-iumyl] ester IUPAC Name: [1-(5-hexylsulfonyl-1,3-thiazol-2-yl)-3-methyl-1-oxidoimidazolidin-1-ium-2-yl] acetate Traditional Name: acetic acid [1-(5-hexylsulfonylthiazol-2-yl)-3-methyl-1-oxido-imidazolidin-1-ium-2-yl] ester Formula: C15H25N3O5S2 MolecularWeight: 391.5061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)C1=CN=C(S1)[N+]2(CCN(C2OC(=O)C)C)[O-]

Isomeric SMILES

CCCCCCS(=O)(=O)C1=CN=C(S1)[N+]2(CCN(C2OC(=O)C)C)[O-]

InChI

InChI=1S/C15H25N3O5S2/c1-4-5-6-7-10-25(21,22)13-11-16-14(24-13)18(20)9-8-17(3)15(18)23-12(2)19/h11,15H,4-10H2,1-3H3