1-[(6-chloranylpyridin-2-yl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-[(6-chloranylpyridin-2-yl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine Openeye Name: 1-[(6-chloro-2-pyridyl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine CAS Name: 1-[(6-chloro-2-pyridinyl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine IUPAC Name: 1-[(6-chloropyridin-2-yl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine Traditional Name: 1-[(6-chloro-2-pyridyl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine Formula: C17H17ClF3N3O2S MolecularWeight: 419.84899

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=CC=C2)Cl)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=NC(=CC=C2)Cl)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C17H17ClF3N3O2S/c18-16-6-2-4-14(22-16)12-23-7-9-24(10-8-23)27(25,26)15-5-1-3-13(11-15)17(19,20)21/h1-6,11H,7-10,12H2