methyl 4-methoxy-3-[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-methoxy-3-[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-methoxy-3-[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate CAS Name: 4-methoxy-3-[[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-methoxy-3-[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-methoxy-3-[[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=NN=C(O2)SCC3=C(C=CC(=C3)C(=O)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=NN=C(O2)SCC3=C(C=CC(=C3)C(=O)OC)OC

InChI

InChI=1S/C20H20N2O5S/c1-13-5-4-6-16(9-13)26-11-18-21-22-20(27-18)28-12-15-10-14(19(23)25-3)7-8-17(15)24-2/h4-10H,11-12H2,1-3H3