4-[[1-(4-ethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]butanoic acid

Systemtic Name: 4-[[1-(4-ethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]butanoic acid Openeye Name: 4-[1-(4-ethylphenyl)tetrazol-5-yl]sulfanylbutanoic acid CAS Name: 4-[[1-(4-ethylphenyl)-5-tetrazolyl]thio]butanoic acid IUPAC Name: 4-[1-(4-ethylphenyl)tetrazol-5-yl]sulfanylbutanoic acid Traditional Name: 4-[[1-(4-ethylphenyl)tetrazol-5-yl]thio]butyric acid Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=NN=N2)SCCCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=NN=N2)SCCCC(=O)O

InChI

InChI=1S/C13H16N4O2S/c1-2-10-5-7-11(8-6-10)17-13(14-15-16-17)20-9-3-4-12(18)19/h5-8H,2-4,9H2,1H3,(H,18,19)