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Substance Name: AFN-1252 tosylate monohydrate
RN: 1047981-30-5
UNII: 004HXS4MNN
InChIKey: OUSNFNLWEQZRCQ-WRQJSNHTSA-N

Molecular Weight

  • 565.6439
 
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Names and Synonyms

Name of Substance

  • AFN-1252 tosylate monohydrate

Synonyms

  • 2-Propenamide, N-methyl-N-((3-methyl-2-benzofuranyl)methyl)-3-(5,6,7,8-tetrahydro-7-oxo-1,8-naphthyridin-3-yl)-, (2E)-, 4-methylbenzenesulfonate, hydrate (1:1:1)
  • AFN-1252 tosylate monohydrate
  • API-1252 tosylate monohydrate
  • UNII-004HXS4MNN

Registry Numbers

CAS Registry Number

  • 1047981-30-5

FDA UNII

  • 004HXS4MNN

System Generated Number

  • 1047981305

Structure Descriptors

InChI

1S/C22H21N3O3.C7H8O3S.H2O/c1-14-17-5-3-4-6-18(17)28-19(14)13-25(2)21(27)10-7-15-11-16-8-9-20(26)24-22(16)23-12-15;1-6-2-4-7(5-3-6)11(8,9)10;/h3-7,10-12H,8-9,13H2,1-2H3,(H,23,24,26);2-5H,1H3,(H,8,9,10);1H2/b10-7+;;

InChIKey

OUSNFNLWEQZRCQ-WRQJSNHTSA-N

Smiles

Cc1ccc(cc1)S(=O)(=O)O.Cc1c2ccccc2oc1CN(C)C(=O)/C=C/c3cc4c(nc3)NC(=O)CC4.O