N,N-diethyl-4-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]carbonyl-piperazine-1-sulfonamide

Systemtic Name: N,N-diethyl-4-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]carbonyl-piperazine-1-sulfonamide Openeye Name: N,N-diethyl-4-[4-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoyl]piperazine-1-sulfonamide CAS Name: N,N-diethyl-4-[oxo-[4-[[7-(trifluoromethyl)-4-quinolinyl]amino]phenyl]methyl]-1-piperazinesulfonamide IUPAC Name: N,N-diethyl-4-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoyl]piperazine-1-sulfonamide Traditional Name: N,N-diethyl-4-[4-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoyl]piperazine-1-sulfonamide Formula: C25H28F3N5O3S MolecularWeight: 535.58173

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

InChI

InChI=1S/C25H28F3N5O3S/c1-3-32(4-2)37(35,36)33-15-13-31(14-16-33)24(34)18-5-8-20(9-6-18)30-22-11-12-29-23-17-19(25(26,27)28)7-10-21(22)23/h5-12,17H,3-4,13-16H2,1-2H3,(H,29,30)