2-[4-(4-ethylsulfanylphenyl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(4-ethylsulfanylphenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(4-ethylsulfanylphenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-[4-(ethylthio)phenyl]-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-ethylsulfanylphenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-[4-(ethylthio)phenyl]thiazol-2-yl]acetic acid Formula: C13H13NO2S2 MolecularWeight: 279.37782

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C2=CSC(=N2)CC(=O)O

Isomeric SMILES

CCSC1=CC=C(C=C1)C2=CSC(=N2)CC(=O)O

InChI

InChI=1S/C13H13NO2S2/c1-2-17-10-5-3-9(4-6-10)11-8-18-12(14-11)7-13(15)16/h3-6,8H,2,7H2,1H3,(H,15,16)