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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[(phenylmethylsulfanyl)methyl]-1,2,4-oxadiazole Openeye Name: 5-(benzylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole CAS Name: 3-(3,4-dimethoxyphenyl)-5-[(phenylmethylthio)methyl]-1,2,4-oxadiazole IUPAC Name: 5-(benzylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[(benzylthio)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)CSCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)CSCC3=CC=CC=C3)OC

InChI

InChI=1S/C18H18N2O3S/c1-21-15-9-8-14(10-16(15)22-2)18-19-17(23-20-18)12-24-11-13-6-4-3-5-7-13/h3-10H,11-12H2,1-2H3