2-[[5-ethyl-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-ethyl-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-ethyl-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-ethyl-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[5-ethyl-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-ethyl-4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]acetate Formula: C11H12N3O3S- MolecularWeight: 266.29628

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC2=CC=CO2)SCC(=O)[O-]

Isomeric SMILES

CCC1=NN=C(N1CC2=CC=CO2)SCC(=O)[O-]

InChI

InChI=1S/C11H13N3O3S/c1-2-9-12-13-11(18-7-10(15)16)14(9)6-8-4-3-5-17-8/h3-5H,2,6-7H2,1H3,(H,15,16)/p-1