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

Systemtic Name: methyl 4-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanylmethyl]benzoate Openeye Name: methyl 4-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanylmethyl]benzoate CAS Name: 4-[[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanylmethyl]benzoate Traditional Name: 4-[[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]methyl]benzoic acid methyl ester Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSCC2=NC(=NO2)C3=CC=CC=C3Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSCC2=NC(=NO2)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H15ClN2O3S/c1-23-18(22)13-8-6-12(7-9-13)10-25-11-16-20-17(21-24-16)14-4-2-3-5-15(14)19/h2-9H,10-11H2,1H3