[3-(5-butylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-yl] furan-2-carboxylate

Systemtic Name: [3-(5-butylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-yl] furan-2-carboxylate Openeye Name: [3-(5-butylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [3-(5-butylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-4-imidazolidin-3-iumyl] ester IUPAC Name: [3-(5-butylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidoimidazolidin-3-ium-4-yl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [3-(5-butylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl] ester Formula: C15H20N4O5S2 MolecularWeight: 400.4731

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)C1=NN=C(S1)[N+]2(CN(CC2OC(=O)C3=CC=CO3)C)[O-]

Isomeric SMILES

CCCCS(=O)C1=NN=C(S1)[N+]2(CN(CC2OC(=O)C3=CC=CO3)C)[O-]

InChI

InChI=1S/C15H20N4O5S2/c1-3-4-8-26(22)15-17-16-14(25-15)19(21)10-18(2)9-12(19)24-13(20)11-6-5-7-23-11/h5-7,12H,3-4,8-10H2,1-2H3