3-(3,4-dimethoxyphenyl)-5-[2-(phenylmethylsulfanyl)ethyl]-1,2,4-oxadiazole

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[2-(phenylmethylsulfanyl)ethyl]-1,2,4-oxadiazole Openeye Name: 5-(2-benzylsulfanylethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole CAS Name: 3-(3,4-dimethoxyphenyl)-5-[2-(phenylmethylthio)ethyl]-1,2,4-oxadiazole IUPAC Name: 5-(2-benzylsulfanylethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[2-(benzylthio)ethyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)CCSCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)CCSCC3=CC=CC=C3)OC

InChI

InChI=1S/C19H20N2O3S/c1-22-16-9-8-15(12-17(16)23-2)19-20-18(24-21-19)10-11-25-13-14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3