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

Systemtic Name: [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-oxidanidyl-1-prop-2-ynyl-imidazolidin-3-ium-4-yl] furan-3-carboxylate Openeye Name: [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-prop-2-ynyl-imidazolidin-3-ium-4-yl] furan-3-carboxylate CAS Name: 3-furancarboxylic acid [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-prop-2-ynyl-4-imidazolidin-3-iumyl] ester IUPAC Name: [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-prop-2-ynylimidazolidin-3-ium-4-yl] furan-3-carboxylate Traditional Name: furan-3-carboxylic acid [3-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-oxido-1-propargyl-imidazolidin-3-ium-4-yl] ester Formula: C16H16N4O4S MolecularWeight: 360.38764

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CC([N+](C1)(C2=NN=C(S2)C3CC3)[O-])OC(=O)C4=COC=C4

Isomeric SMILES

C#CCN1CC([N+](C1)(C2=NN=C(S2)C3CC3)[O-])OC(=O)C4=COC=C4

InChI

InChI=1S/C16H16N4O4S/c1-2-6-19-8-13(24-15(21)12-5-7-23-9-12)20(22,10-19)16-18-17-14(25-16)11-3-4-11/h1,5,7,9,11,13H,3-4,6,8,10H2