Hexanamide, 2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)-2-fluorophenyl]-, (2S)-, methanesulfonate (1:2)

CAS Registry Number®

468719-53-1

CAS Name

Hexanamide, 2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)-2-fluorophenyl]-, (2S)-, methanesulfonate (1:2)

Molecular Formula

C22H23F3N4O3.2CH4O3S

Cite this Page

Hexanamide, 2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)-2-fluorophenyl]-, (2S)-, methanesulfonate (1:2).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=468719-53-1 (retrieved 2024-11-22) (CAS RN: 468719-53-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H23F3N4O3.CH4O3S/c1-10-18(24)20(28)17-15(30)9-16(32-21(17)19(10)25)11-5-6-14(12(23)8-11)29-22(31)13(27)4-2-3-7-26;1-5(2,3)4/h5-6,8-9,13H,2-4,7,26-28H2,1H3,(H,29,31);1H3,(H,2,3,4)/t13-;/m0./s1

InChIKey

InChIKey=MJVICFBYAVBBOA-ZOWNYOTGSA-N

SMILES

FC1=C2C(C(=O)C=C(O2)C3=CC(F)=C(NC([C@H](CCCCN)N)=O)C=C3)=C(N)C(F)=C1C.S(C)(=O)(=O)O

Canonical SMILES

O=C1C=C(OC=2C(F)=C(C(F)=C(N)C12)C)C=3C=CC(NC(=O)C(N)CCCCN)=C(F)C3.O=S(=O)(O)C

Other Names for this Substance

  • Hexanamide, 2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)-2-fluorophenyl]-, (2S)-, methanesulfonate (1:2)
  • Hexanamide, 2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)-2-fluorophenyl]-, (2S)-, dimethanesulfonate
  • AFP 464
  • NSC 710464

CAS INSIGHTSTM
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