phenyl 2-[[1-(2-ethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate

Systemtic Name: phenyl 2-[[1-(2-ethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: phenyl 2-[1-(2-ethylphenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(2-ethylphenyl)-5-tetrazolyl]thio]acetic acid phenyl ester IUPAC Name: phenyl 2-[1-(2-ethylphenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(2-ethylphenyl)tetrazol-5-yl]thio]acetic acid phenyl ester Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=NN=N2)SCC(=O)OC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1N2C(=NN=N2)SCC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C17H16N4O2S/c1-2-13-8-6-7-11-15(13)21-17(18-19-20-21)24-12-16(22)23-14-9-4-3-5-10-14/h3-11H,2,12H2,1H3