2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazole

Systemtic Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazole Openeye Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazole CAS Name: 2-[2-(4-bromophenyl)sulfonylethylthio]-5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazole IUPAC Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazole Traditional Name: 2-(2-brosylethylthio)-5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazole Formula: C18H17BrN2O4S2 MolecularWeight: 469.37258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=NN=C(O2)SCCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=NN=C(O2)SCCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O4S2/c1-13-3-2-4-15(11-13)24-12-17-20-21-18(25-17)26-9-10-27(22,23)16-7-5-14(19)6-8-16/h2-8,11H,9-10,12H2,1H3