methyl 5-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[5-(2-furanyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C14H13N3O4S MolecularWeight: 319.33572

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=C(O2)C(=O)OC)C3=CC=CO3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=C(O2)C(=O)OC)C3=CC=CO3

InChI

InChI=1S/C14H13N3O4S/c1-17-12(10-4-3-7-20-10)15-16-14(17)22-8-9-5-6-11(21-9)13(18)19-2/h3-7H,8H2,1-2H3