2-[(3-bromophenyl)methylsulfanyl]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-[(3-bromophenyl)methylthio]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-[(3-bromobenzyl)thio]-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazole Formula: C17H15BrN2O3S MolecularWeight: 407.2816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=CC(=CC=C3)Br)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=CC(=CC=C3)Br)OC

InChI

InChI=1S/C17H15BrN2O3S/c1-21-14-7-12(8-15(9-14)22-2)16-19-20-17(23-16)24-10-11-4-3-5-13(18)6-11/h3-9H,10H2,1-2H3