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

Systemtic Name: methyl 2-methyl-5-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[[1-(o-tolyl)tetrazol-5-yl]sulfanylmethyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[[1-(2-methylphenyl)-5-tetrazolyl]thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[[1-(2-methylphenyl)tetrazol-5-yl]sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-methyl-5-[[[1-(o-tolyl)tetrazol-5-yl]thio]methyl]furan-3-carboxylic acid methyl ester Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=N2)SCC3=CC(=C(O3)C)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=N2)SCC3=CC(=C(O3)C)C(=O)OC

InChI

InChI=1S/C16H16N4O3S/c1-10-6-4-5-7-14(10)20-16(17-18-19-20)24-9-12-8-13(11(2)23-12)15(21)22-3/h4-8H,9H2,1-3H3