5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=CC4=C(C=C3)OCCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=CC4=C(C=C3)OCCO4)OC

InChI

InChI=1S/C19H18N2O5S/c1-22-14-5-3-12(9-16(14)23-2)19-20-18(26-21-19)11-27-13-4-6-15-17(10-13)25-8-7-24-15/h3-6,9-10H,7-8,11H2,1-2H3