2-(1,3-benzodioxol-5-yl)-5-(3-methylbut-2-enylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5-(3-methylbut-2-enylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-(1,3-benzodioxol-5-yl)-5-(3-methylbut-2-enylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-(1,3-benzodioxol-5-yl)-5-(3-methylbut-2-enylthio)-1,3,4-oxadiazole IUPAC Name: 2-(1,3-benzodioxol-5-yl)-5-(3-methylbut-2-enylsulfanyl)-1,3,4-oxadiazole Traditional Name: 2-(1,3-benzodioxol-5-yl)-5-(3-methylbut-2-enylthio)-1,3,4-oxadiazole Formula: C14H14N2O3S MolecularWeight: 290.33756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=NN=C(O1)C2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC(=CCSC1=NN=C(O1)C2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C14H14N2O3S/c1-9(2)5-6-20-14-16-15-13(19-14)10-3-4-11-12(7-10)18-8-17-11/h3-5,7H,6,8H2,1-2H3