• 
  [Synonyms]
  Fansimef
  MSP 4
  Mefloquine-sulfadoxine-pyrimethamine
  LS-186828
  Mefloquine hydrochloride combination with sulfadoxine and pyrimethamine
  Benzenesulfonamide, 4-amino-N-(5,6-dimethoxy-4-pyrimidinyl)-, mixt. with 5-(4-chlorophenyl)-6-ethyl-2,4-pyrimidinediamine and (R*,S*)-(+-)-alpha-2-piperidinyl-2,8-bis(trifluoromethyl)-4-quinolinemethanol monohydrochloride
  69191-18-0
  
  [Structure]
  
  
  
  [ Properties Computed from Structure]
  

  Molecular Weight	973.813479 [g/mol]
  Molecular Formula	C41H44Cl2F6N10O5S
  H-Bond Donor	7
  H-Bond Acceptor	21
  Rotatable Bond Count	9
  Tautomer Count	51
  Exact Mass	972.24981
  MonoIsotopic Mass	972.24981
  Topological Polar Surface Area	239
  Heavy Atom Count	65
  Formal Charge	0
  Complexity	1150
  Isotope Atom Count	0
  Defined Atom StereoCenter Count	2
  Undefined Atom StereoCenter Count	0
  Defined Bond StereoCenter Count	0
  Undefined Bond StereoCenter Count	0
  Covalently-Bonded Unit Count	4

  
  [ Descriptors Computed from Structure]
  IUPAC Name: 4-amino-N-(5,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;
  (S)-[2,
  8-bis(trifluoromethyl)quinolin-4-yl]-[(2R)-piperidin-2-yl]methanol;
  5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine; hydrochloride
  Canonical SMILES: CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.COC1=C(N=CN=C1OC)NS(=O)(=O)C2=CC=C
  (C=C2)N.C1CCNC(C1)C(C2=CC(=NC3=C2C=CC=C3C(F)(F)F)C(F)(F)F)O.Cl
  Isomeric SMILES: CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.COC1=C(N=CN=C1OC)NS(=O)(=O)C2=CC=C
  (C=C2)N.C1CCN[C@H](C1)[C@H](C2=CC(=NC3=C2C=CC=C3C(F)(F)F)C(F)(F)F)O.Cl
  InChI: InChI=1/C17H16F6N2O.C12H13ClN4.C12H14N4O4S.ClH/c18-16(19,
  20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,
  22)23)25-14(9)11;1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7;1-19-10-
  11(14-7-15-12(10)20-2)16-21(17,18)9-5-3-8(13)4-6-9;/h3-5,8,12,15,24,26H,
  1-2,6-7H2;3-6H,2H2,1H3,(H4,14,15,16,17);3-7H,13H2,1-2H3,(H,14,15,
  16);1H/t12-,15+;;;/m1.../s1/f/h;14-15H2;16H;