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

Systemtic Name: 1-[6-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]pyridin-3-yl]sulfonyl-4-methyl-piperazine Openeye Name: 1-[[6-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-3-pyridyl]sulfonyl]-4-methyl-piperazine CAS Name: 1-[[6-[(2-chloro-6-fluorophenyl)methylthio]-3-pyridinyl]sulfonyl]-4-methylpiperazine IUPAC Name: 1-[6-[(2-chloro-6-fluorophenyl)methylsulfanyl]pyridin-3-yl]sulfonyl-4-methylpiperazine Traditional Name: 1-[[6-[(2-chloro-6-fluoro-benzyl)thio]-3-pyridyl]sulfonyl]-4-methyl-piperazine Formula: C17H19ClFN3O2S2 MolecularWeight: 415.933063

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H19ClFN3O2S2/c1-21-7-9-22(10-8-21)26(23,24)13-5-6-17(20-11-13)25-12-14-15(18)3-2-4-16(14)19/h2-6,11H,7-10,12H2,1H3