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

Systemtic Name: 3-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-1-prop-2-enyl-imidazolidin-3-ium-4-ol Openeye Name: 1-allyl-3-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol CAS Name: 3-[5-(hexylthio)-1,3,4-thiadiazol-2-yl]-3-oxido-1-prop-2-enyl-4-imidazolidin-3-iumol IUPAC Name: 3-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-prop-2-enylimidazolidin-3-ium-4-ol Traditional Name: 1-allyl-3-[5-(hexylthio)-1,3,4-thiadiazol-2-yl]-3-oxido-imidazolidin-3-ium-4-ol Formula: C14H24N4O2S2 MolecularWeight: 344.49596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NN=C(S1)[N+]2(CN(CC2O)CC=C)[O-]

Isomeric SMILES

CCCCCCSC1=NN=C(S1)[N+]2(CN(CC2O)CC=C)[O-]

InChI

InChI=1S/C14H24N4O2S2/c1-3-5-6-7-9-21-14-16-15-13(22-14)18(20)11-17(8-4-2)10-12(18)19/h4,12,19H,2-3,5-11H2,1H3