2-[(6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(phenylmethyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(phenylmethyl)-1,3,4-oxadiazole Openeye Name: 2-benzyl-5-[(6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-[(6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]-5-(phenylmethyl)-1,3,4-oxadiazole IUPAC Name: 2-benzyl-5-[(6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-benzyl-5-[(6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-oxadiazole Formula: C24H19BrN2O3S MolecularWeight: 495.38826

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)CSC4=NN=C(O4)CC5=CC=CC=C5)Br

Isomeric SMILES

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)CSC4=NN=C(O4)CC5=CC=CC=C5)Br

InChI

InChI=1S/C24H19BrN2O3S/c25-20-12-18-14-28-23(17-9-5-2-6-10-17)30-22(18)19(13-20)15-31-24-27-26-21(29-24)11-16-7-3-1-4-8-16/h1-10,12-13,23H,11,14-15H2