methyl 2-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]ethanoate Openeye Name: methyl 2-[[5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]acetate CAS Name: 2-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]acetate Traditional Name: 2-[[5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methylthio]acetic acid methyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)CSCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)CSCC(=O)OC

InChI

InChI=1S/C13H14N2O3S/c1-9-3-5-10(6-4-9)13-14-11(15-18-13)7-19-8-12(16)17-2/h3-6H,7-8H2,1-2H3