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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5-phenethylsulfanyl-1,3,4-oxadiazole Openeye Name: 2-(1,3-benzodioxol-5-yl)-5-phenethylsulfanyl-1,3,4-oxadiazole CAS Name: 2-(1,3-benzodioxol-5-yl)-5-(phenethylthio)-1,3,4-oxadiazole IUPAC Name: 2-(1,3-benzodioxol-5-yl)-5-phenethylsulfanyl-1,3,4-oxadiazole Traditional Name: 2-(1,3-benzodioxol-5-yl)-5-(phenethylthio)-1,3,4-oxadiazole Formula: C17H14N2O3S MolecularWeight: 326.36966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCCC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCCC4=CC=CC=C4

InChI

InChI=1S/C17H14N2O3S/c1-2-4-12(5-3-1)8-9-23-17-19-18-16(22-17)13-6-7-14-15(10-13)21-11-20-14/h1-7,10H,8-9,11H2