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

Systemtic Name: methyl 2-[[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-[[1-(2-thienylmethyl)tetrazol-5-yl]sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[[1-(thiophen-2-ylmethyl)-5-tetrazolyl]thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[1-(thiophen-2-ylmethyl)tetrazol-5-yl]sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[[1-(2-thenyl)tetrazol-5-yl]thio]methyl]furan-3-carboxylic acid methyl ester Formula: C13H12N4O3S2 MolecularWeight: 336.38938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC=C1)CSC2=NN=NN2CC3=CC=CS3

Isomeric SMILES

COC(=O)C1=C(OC=C1)CSC2=NN=NN2CC3=CC=CS3

InChI

InChI=1S/C13H12N4O3S2/c1-19-12(18)10-4-5-20-11(10)8-22-13-14-15-16-17(13)7-9-3-2-6-21-9/h2-6H,7-8H2,1H3