(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-methoxy-4-methylsulfanyl-benzoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-methoxy-4-methylsulfanyl-benzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-methoxy-4-methylsulfanyl-benzoate CAS Name: 2-methoxy-4-(methylthio)benzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-methoxy-4-methylsulfanylbenzoate Traditional Name: 2-methoxy-4-(methylthio)benzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O4S/c1-22-15-10-13(25-2)8-9-14(15)18(21)23-11-16-19-17(20-24-16)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3