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

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole CAS Name: 3-[2-(4-bromophenyl)sulfonylethylthio]-5-cyclopropyl-4-ethyl-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole Traditional Name: 3-(2-brosylethylthio)-5-cyclopropyl-4-ethyl-1,2,4-triazole Formula: C15H18BrN3O2S2 MolecularWeight: 416.35632

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3CC3

Isomeric SMILES

CCN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)Br)C3CC3

InChI

InChI=1S/C15H18BrN3O2S2/c1-2-19-14(11-3-4-11)17-18-15(19)22-9-10-23(20,21)13-7-5-12(16)6-8-13/h5-8,11H,2-4,9-10H2,1H3