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Substance Name: Simenepag [USAN:INN]
RN: 910562-15-1
UNII: V0LI771S16
InChIKey: NGKFLYGSJDSBQC-QUCCMNQESA-N

Classification Code

  • Treatment of Glaucoma, Ocular Hypertension

Molecular Formula

  • C23-H29-N-O5-S

Molecular Weight

  • 431.5501
 
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Names and Synonyms

Name of Substance

  • Simenepag [USAN:INN]

Synonyms

  • 5-((((2R)-1-(4-((1S)-1-Hydroxyhexyl)phenyl)-5-oxopyrrolidin-2-yl)methoxy)methyl) thiophene-2-carboxylic acid
  • AGN-210676
  • Simenepag
  • UNII-V0LI771S16

Systematic Name

  • 2-Thiophenecarboxylic acid, 5-((((2R)-1-(4-((1S)-1-hydroxyhexyl)phenyl)-5-oxo-2- pyrrolidinyl)methoxy)methyl)-

Registry Numbers

CAS Registry Number

  • 910562-15-1

FDA UNII

  • V0LI771S16

System Generated Number

  • 0910562151

Structure Descriptors

InChI

1S/C23H29NO5S/c1-2-3-4-5-20(25)16-6-8-17(9-7-16)24-18(10-13-22(24)26)14-29-15-19-11-12-21(30-19)23(27)28/h6-9,11-12,18,20,25H,2-5,10,13-15H2,1H3,(H,27,28)/t18-,20+/m1/s1

InChIKey

NGKFLYGSJDSBQC-QUCCMNQESA-N

Smiles

CCCCC[C@@H](c1ccc(cc1)N2[C@H](CCC2=O)COCc3ccc(s3)C(=O)O)O