3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-ethyl-5-phenyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-ethyl-5-phenyl-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-ethyl-5-phenyl-1,2,4-triazole CAS Name: 3-[2-(4-bromophenyl)sulfonylethylthio]-4-ethyl-5-phenyl-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-ethyl-5-phenyl-1,2,4-triazole Traditional Name: 3-(2-brosylethylthio)-4-ethyl-5-phenyl-1,2,4-triazole Formula: C18H18BrN3O2S2 MolecularWeight: 452.38842

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C18H18BrN3O2S2/c1-2-22-17(14-6-4-3-5-7-14)20-21-18(22)25-12-13-26(23,24)16-10-8-15(19)9-11-16/h3-11H,2,12-13H2,1H3