2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-(4-ethoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-(4-ethoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-(4-ethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-5-(4-ethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5-(4-ethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-(piperonylthio)-5-p-phenetyl-1,3,4-oxadiazole Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16N2O4S/c1-2-21-14-6-4-13(5-7-14)17-19-20-18(24-17)25-10-12-3-8-15-16(9-12)23-11-22-15/h3-9H,2,10-11H2,1H3