2-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]acetic acid CAS Name: 2-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]acetic acid IUPAC Name: 2-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]acetic acid Traditional Name: 2-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]acetic acid Formula: C12H12N2O4S MolecularWeight: 280.29968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)CSCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)CSCC(=O)O

InChI

InChI=1S/C12H12N2O4S/c1-17-9-4-2-8(3-5-9)12-13-10(18-14-12)6-19-7-11(15)16/h2-5H,6-7H2,1H3,(H,15,16)