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

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(3-chlorophenyl)-4-ethyl-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(3-chlorophenyl)-4-ethyl-1,2,4-triazole CAS Name: 3-[2-(4-bromophenyl)sulfonylethylthio]-5-(3-chlorophenyl)-4-ethyl-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(3-chlorophenyl)-4-ethyl-1,2,4-triazole Traditional Name: 3-(2-brosylethylthio)-5-(3-chlorophenyl)-4-ethyl-1,2,4-triazole Formula: C18H17BrClN3O2S2 MolecularWeight: 486.83348

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrClN3O2S2/c1-2-23-17(13-4-3-5-15(20)12-13)21-22-18(23)26-10-11-27(24,25)16-8-6-14(19)7-9-16/h3-9,12H,2,10-11H2,1H3