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

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-cyclohexyl-5-methyl-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-cyclohexyl-5-methyl-1,2,4-triazole CAS Name: 3-[2-(4-bromophenyl)sulfonylethylthio]-4-cyclohexyl-5-methyl-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-4-cyclohexyl-5-methyl-1,2,4-triazole Traditional Name: 3-(2-brosylethylthio)-4-cyclohexyl-5-methyl-1,2,4-triazole Formula: C17H22BrN3O2S2 MolecularWeight: 444.40948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SCCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SCCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H22BrN3O2S2/c1-13-19-20-17(21(13)15-5-3-2-4-6-15)24-11-12-25(22,23)16-9-7-14(18)8-10-16/h7-10,15H,2-6,11-12H2,1H3