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

Systemtic Name: methyl 3-[[1-(3-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 3-[[1-(m-tolyl)tetrazol-5-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 3-[[[1-(3-methylphenyl)-5-tetrazolyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-[[1-(3-methylphenyl)tetrazol-5-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 3-[[[1-(m-tolyl)tetrazol-5-yl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C15H14N4O3S MolecularWeight: 330.36166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=N2)SCC3=C(OC=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=N2)SCC3=C(OC=C3)C(=O)OC

InChI

InChI=1S/C15H14N4O3S/c1-10-4-3-5-12(8-10)19-15(16-17-18-19)23-9-11-6-7-22-13(11)14(20)21-2/h3-8H,9H2,1-2H3