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

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole CAS Name: 2-[(3-bromophenyl)methylthio]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole Traditional Name: 2-[(3-bromobenzyl)thio]-5-(3,5-dimethylphenyl)-1,3,4-oxadiazole Formula: C17H15BrN2OS MolecularWeight: 375.2828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=CC(=CC=C3)Br)C

InChI

InChI=1S/C17H15BrN2OS/c1-11-6-12(2)8-14(7-11)16-19-20-17(21-16)22-10-13-4-3-5-15(18)9-13/h3-9H,10H2,1-2H3