2-(1,3-benzodioxol-5-ylmethyl)-5-(2-methoxyethylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-5-(2-methoxyethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-5-(2-methoxyethylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-5-(2-methoxyethylthio)-1,3,4-oxadiazole IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-5-(2-methoxyethylsulfanyl)-1,3,4-oxadiazole Traditional Name: 2-(2-methoxyethylthio)-5-piperonyl-1,3,4-oxadiazole Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

COCCSC1=NN=C(O1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COCCSC1=NN=C(O1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H14N2O4S/c1-16-4-5-20-13-15-14-12(19-13)7-9-2-3-10-11(6-9)18-8-17-10/h2-3,6H,4-5,7-8H2,1H3