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

Systemtic Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanoate Openeye Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]acetate CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]acetic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]acetate Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]acetic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)OCC2=NN=C(O2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)OCC2=NN=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O5S/c1-14(24)16-8-9-18(26-2)17(10-16)12-29-13-20(25)27-11-19-22-23-21(28-19)15-6-4-3-5-7-15/h3-10H,11-13H2,1-2H3