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

Systemtic Name: [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(4-methylphenyl)sulfanylpropanoate Openeye Name: [3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl 3-(p-tolylsulfanyl)propanoate CAS Name: 3-[(4-methylphenyl)thio]propanoic acid [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(4-methylphenyl)sulfanylpropanoate Traditional Name: 3-(p-tolylthio)propionic acid [3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCSC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCSC3=CC=C(C=C3)C

InChI

InChI=1S/C20H20N2O3S/c1-14-3-7-16(8-4-14)20-21-18(25-22-20)13-24-19(23)11-12-26-17-9-5-15(2)6-10-17/h3-10H,11-13H2,1-2H3