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

Systemtic Name: [1-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-imidazolidin-3-ium-4-yl] furan-2-carboxylate Openeye Name: [1-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-yl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [1-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-3-oxido-4-imidazolidin-3-iumyl] ester IUPAC Name: [1-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-3-oxidoimidazolidin-3-ium-4-yl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [1-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-yl] ester Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)[N+]2(CN(CC2OC(=O)C3=CC=CO3)C)[O-]

Isomeric SMILES

CC1=NN=C(S1)[N+]2(CN(CC2OC(=O)C3=CC=CO3)C)[O-]

InChI

InChI=1S/C12H14N4O4S/c1-8-13-14-12(21-8)16(18)7-15(2)6-10(16)20-11(17)9-4-3-5-19-9/h3-5,10H,6-7H2,1-2H3