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

Systemtic Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(methylsulfanylmethyl)-1,3,4-oxadiazole Openeye Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(methylsulfanylmethyl)-1,3,4-oxadiazole CAS Name: 2-[2-(4-bromophenyl)sulfonylethylthio]-5-[(methylthio)methyl]-1,3,4-oxadiazole IUPAC Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(methylsulfanylmethyl)-1,3,4-oxadiazole Traditional Name: 2-(2-brosylethylthio)-5-[(methylthio)methyl]-1,3,4-oxadiazole Formula: C12H13BrN2O3S3 MolecularWeight: 409.34222

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=NN=C(O1)SCCS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CSCC1=NN=C(O1)SCCS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H13BrN2O3S3/c1-19-8-11-14-15-12(18-11)20-6-7-21(16,17)10-4-2-9(13)3-5-10/h2-5H,6-8H2,1H3