2-[3-(furan-2-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoic acid

Systemtic Name: 2-[3-(furan-2-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoic acid Openeye Name: 2-[3-(2-furyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetic acid CAS Name: 2-[3-(2-furanyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetic acid IUPAC Name: 2-[3-(furan-2-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetic acid Traditional Name: 2-[3-(2-furyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetic acid Formula: C8H7N3O3S MolecularWeight: 225.22448

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=NNC(=S)N2CC(=O)O

Isomeric SMILES

C1=COC(=C1)C2=NNC(=S)N2CC(=O)O

InChI

InChI=1S/C8H7N3O3S/c12-6(13)4-11-7(9-10-8(11)15)5-2-1-3-14-5/h1-3H,4H2,(H,10,15)(H,12,13)