2-[[5-(4-tert-butylphenyl)-1,2,3-thiadiazol-4-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[5-(4-tert-butylphenyl)-1,2,3-thiadiazol-4-yl]sulfanyl]ethanoic acid Openeye Name: 2-[5-(4-tert-butylphenyl)thiadiazol-4-yl]sulfanylacetic acid CAS Name: 2-[[5-(4-tert-butylphenyl)-4-thiadiazolyl]thio]acetic acid IUPAC Name: 2-[5-(4-tert-butylphenyl)thiadiazol-4-yl]sulfanylacetic acid Traditional Name: 2-[[5-(4-tert-butylphenyl)thiadiazol-4-yl]thio]acetic acid Formula: C14H16N2O2S2 MolecularWeight: 308.41904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(N=NS2)SCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(N=NS2)SCC(=O)O

InChI

InChI=1S/C14H16N2O2S2/c1-14(2,3)10-6-4-9(5-7-10)12-13(15-16-20-12)19-8-11(17)18/h4-7H,8H2,1-3H3,(H,17,18)