2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-5-(4-ethoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-5-(4-ethoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-5-(4-ethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-5-(4-ethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-5-(4-ethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-5-p-phenetyl-1,3,4-oxadiazole Formula: C18H15BrN2O4S MolecularWeight: 435.2917

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC4=C(C=C3Br)OCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC4=C(C=C3Br)OCO4

InChI

InChI=1S/C18H15BrN2O4S/c1-2-22-13-5-3-11(4-6-13)17-20-21-18(25-17)26-9-12-7-15-16(8-14(12)19)24-10-23-15/h3-8H,2,9-10H2,1H3