3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-1-prop-2-enyl-imidazolidin-3-ium-4-ol

Systemtic Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-1-prop-2-enyl-imidazolidin-3-ium-4-ol Openeye Name: 1-allyl-3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol CAS Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-prop-2-enyl-4-imidazolidin-3-iumol IUPAC Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-prop-2-enylimidazolidin-3-ium-4-ol Traditional Name: 1-allyl-3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol Formula: C12H20N4O4S2 MolecularWeight: 348.4416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=NN=C(S1)[N+]2(CN(CC2O)CC=C)[O-]

Isomeric SMILES

CCCCS(=O)(=O)C1=NN=C(S1)[N+]2(CN(CC2O)CC=C)[O-]

InChI

InChI=1S/C12H20N4O4S2/c1-3-5-7-22(19,20)12-14-13-11(21-12)16(18)9-15(6-4-2)8-10(16)17/h4,10,17H,2-3,5-9H2,1H3