3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole CAS Name: 3-[2-(4-bromophenyl)sulfonylethylthio]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole Traditional Name: 3-(2-brosylethylthio)-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole Formula: C17H15BrFN3O2S2 MolecularWeight: 456.352303

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3F

Isomeric SMILES

CN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3F

InChI

InChI=1S/C17H15BrFN3O2S2/c1-22-16(14-4-2-3-5-15(14)19)20-21-17(22)25-10-11-26(23,24)13-8-6-12(18)7-9-13/h2-9H,10-11H2,1H3