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

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole Formula: C18H15BrN2O3S MolecularWeight: 419.2923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=CC4=C(C=C3Br)OCO4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=CC4=C(C=C3Br)OCO4)C

InChI

InChI=1S/C18H15BrN2O3S/c1-10-3-11(2)5-12(4-10)17-20-21-18(24-17)25-8-13-6-15-16(7-14(13)19)23-9-22-15/h3-7H,8-9H2,1-2H3