3-pyridin-3-yl-1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-pyridin-3-yl-1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(3-pyridyl)-1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(3-pyridinyl)-1-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-pyridin-3-yl-1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(3-pyridyl)-1-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]propan-1-one Formula: C19H20F3N3O3S MolecularWeight: 427.44061

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H20F3N3O3S/c20-19(21,22)16-4-6-17(7-5-16)29(27,28)25-12-10-24(11-13-25)18(26)8-3-15-2-1-9-23-14-15/h1-2,4-7,9,14H,3,8,10-13H2