[3-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-1-propyl-imidazolidin-3-ium-4-yl] 2-(furan-2-yl)ethanoate

Systemtic Name: [3-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-1-propyl-imidazolidin-3-ium-4-yl] 2-(furan-2-yl)ethanoate Openeye Name: [3-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-propyl-imidazolidin-3-ium-4-yl] 2-(2-furyl)acetate CAS Name: 2-(2-furanyl)acetic acid [3-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-3-oxido-1-propyl-4-imidazolidin-3-iumyl] ester IUPAC Name: [3-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-propylimidazolidin-3-ium-4-yl] 2-(furan-2-yl)acetate Traditional Name: 2-(2-furyl)acetic acid [3-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-3-oxido-1-propyl-imidazolidin-3-ium-4-yl] ester Formula: C15H20N4O4S2 MolecularWeight: 384.4737

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC([N+](C1)(C2=NN=C(S2)SC)[O-])OC(=O)CC3=CC=CO3

Isomeric SMILES

CCCN1CC([N+](C1)(C2=NN=C(S2)SC)[O-])OC(=O)CC3=CC=CO3

InChI

InChI=1S/C15H20N4O4S2/c1-3-6-18-9-12(23-13(20)8-11-5-4-7-22-11)19(21,10-18)14-16-17-15(24-2)25-14/h4-5,7,12H,3,6,8-10H2,1-2H3