methyl 2-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[1-(p-tolyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(4-methylphenyl)-5-tetrazolyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-methylphenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(p-tolyl)tetrazol-5-yl]thio]acetic acid methyl ester Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N4O2S/c1-8-3-5-9(6-4-8)15-11(12-13-14-15)18-7-10(16)17-2/h3-6H,7H2,1-2H3