[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-phenylsulfanylpropanoate

Systemtic Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-phenylsulfanylpropanoate Openeye Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN2O3S/c19-14-8-6-13(7-9-14)18-20-16(24-21-18)12-23-17(22)10-11-25-15-4-2-1-3-5-15/h1-9H,10-12H2