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

Systemtic Name: methyl 2-methyl-5-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-methyl-5-[[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]methyl]furan-3-carboxylic acid methyl ester Formula: C14H13N3O3S2 MolecularWeight: 335.40132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NNC(=N2)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NNC(=N2)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C14H13N3O3S2/c1-8-10(13(18)19-2)6-9(20-8)7-22-14-15-12(16-17-14)11-4-3-5-21-11/h3-6H,7H2,1-2H3,(H,15,16,17)