2-(hydroxymethyl)-3-(2-sulfanylidene-3H-1,3-thiazol-4-yl)-2,5-dihydropyrrole-1-carboxylate

Systemtic Name: 2-(hydroxymethyl)-3-(2-sulfanylidene-3H-1,3-thiazol-4-yl)-2,5-dihydropyrrole-1-carboxylate Openeye Name: 2-(hydroxymethyl)-3-(2-thioxo-3H-thiazol-4-yl)-2,5-dihydropyrrole-1-carboxylate CAS Name: 2-(hydroxymethyl)-3-(2-sulfanylidene-3H-thiazol-4-yl)-2,5-dihydropyrrole-1-carboxylate IUPAC Name: 2-(hydroxymethyl)-3-(2-sulfanylidene-3H-1,3-thiazol-4-yl)-2,5-dihydropyrrole-1-carboxylate Traditional Name: 2-methylol-3-(2-thioxo-4-thiazolin-4-yl)-3-pyrroline-1-carboxylate Formula: C9H9N2O3S2- MolecularWeight: 257.30936

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(N1C(=O)[O-])CO)C2=CSC(=S)N2

Isomeric SMILES

C1C=C(C(N1C(=O)[O-])CO)C2=CSC(=S)N2

InChI

InChI=1S/C9H10N2O3S2/c12-3-7-5(1-2-11(7)9(13)14)6-4-16-8(15)10-6/h1,4,7,12H,2-3H2,(H,10,15)(H,13,14)/p-1