4-[[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]quinoline

Systemtic Name: 4-[[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]quinoline Openeye Name: 4-[[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]quinoline CAS Name: 4-[[4-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]quinoline IUPAC Name: 4-[[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]quinoline Traditional Name: 4-[[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazino]methyl]quinoline Formula: C22H19F6N3O2S MolecularWeight: 503.460579

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC3=CC=CC=C23)S(=O)(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=NC3=CC=CC=C23)S(=O)(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C22H19F6N3O2S/c23-21(24,25)16-11-17(22(26,27)28)13-18(12-16)34(32,33)31-9-7-30(8-10-31)14-15-5-6-29-20-4-2-1-3-19(15)20/h1-6,11-13H,7-10,14H2