2-[2-[(6-chloranylpyridin-3-yl)methylsulfanyl]-4-methyl-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-[(6-chloranylpyridin-3-yl)methylsulfanyl]-4-methyl-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-[(6-chloro-3-pyridyl)methylsulfanyl]-4-methyl-thiazol-5-yl]acetic acid CAS Name: 2-[2-[(6-chloro-3-pyridinyl)methylthio]-4-methyl-5-thiazolyl]acetic acid IUPAC Name: 2-[2-[(6-chloropyridin-3-yl)methylsulfanyl]-4-methyl-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-[(6-chloro-3-pyridyl)methylthio]-4-methyl-thiazol-5-yl]acetic acid Formula: C12H11ClN2O2S2 MolecularWeight: 314.81094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCC2=CN=C(C=C2)Cl)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SCC2=CN=C(C=C2)Cl)CC(=O)O

InChI

InChI=1S/C12H11ClN2O2S2/c1-7-9(4-11(16)17)19-12(15-7)18-6-8-2-3-10(13)14-5-8/h2-3,5H,4,6H2,1H3,(H,16,17)