2-[[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[2-(4-chlorophenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]acetic acid CAS Name: 2-[[2-(4-chlorophenyl)-5-methyl-4-oxazolyl]methylthio]acetic acid IUPAC Name: 2-[[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]acetic acid Traditional Name: 2-[[2-(4-chlorophenyl)-5-methyl-oxazol-4-yl]methylthio]acetic acid Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)Cl)CSCC(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)Cl)CSCC(=O)O

InChI

InChI=1S/C13H12ClNO3S/c1-8-11(6-19-7-12(16)17)15-13(18-8)9-2-4-10(14)5-3-9/h2-5H,6-7H2,1H3,(H,16,17)