1-[6-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]pyridin-3-yl]sulfonyl-4-methyl-piperazine

Systemtic Name: 1-[6-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]pyridin-3-yl]sulfonyl-4-methyl-piperazine Openeye Name: 1-[[6-[(2-bromo-4-fluoro-phenyl)methylsulfanyl]-3-pyridyl]sulfonyl]-4-methyl-piperazine CAS Name: 1-[[6-[(2-bromo-4-fluorophenyl)methylthio]-3-pyridinyl]sulfonyl]-4-methylpiperazine IUPAC Name: 1-[6-[(2-bromo-4-fluorophenyl)methylsulfanyl]pyridin-3-yl]sulfonyl-4-methylpiperazine Traditional Name: 1-[[6-[(2-bromo-4-fluoro-benzyl)thio]-3-pyridyl]sulfonyl]-4-methyl-piperazine Formula: C17H19BrFN3O2S2 MolecularWeight: 460.384063

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=C(C=C(C=C3)F)Br

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C17H19BrFN3O2S2/c1-21-6-8-22(9-7-21)26(23,24)15-4-5-17(20-11-15)25-12-13-2-3-14(19)10-16(13)18/h2-5,10-11H,6-9,12H2,1H3