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

Systemtic Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-1-prop-2-enyl-imidazolidin-3-ium-4-ol Openeye Name: 1-allyl-3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol CAS Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-prop-2-enyl-4-imidazolidin-3-iumol IUPAC Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-prop-2-enylimidazolidin-3-ium-4-ol Traditional Name: 1-allyl-3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol Formula: C12H20N4O2S MolecularWeight: 284.3778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N4O2S/c1-5-6-15-7-9(17)16(18,8-15)11-14-13-10(19-11)12(2,3)4/h5,9,17H,1,6-8H2,2-4H3