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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-(1,3-benzodioxol-5-yl)-5-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-(1,3-benzodioxol-5-yl)-5-[(4-bromo-2-fluorophenyl)methylthio]-1,3,4-oxadiazole IUPAC Name: 2-(1,3-benzodioxol-5-yl)-5-[(4-bromo-2-fluorophenyl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-(1,3-benzodioxol-5-yl)-5-[(4-bromo-2-fluoro-benzyl)thio]-1,3,4-oxadiazole Formula: C16H10BrFN2O3S MolecularWeight: 409.229603

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C16H10BrFN2O3S/c17-11-3-1-10(12(18)6-11)7-24-16-20-19-15(23-16)9-2-4-13-14(5-9)22-8-21-13/h1-6H,7-8H2