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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H34FN3O4S
Molecular Weight 539.661
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OLACAFTOR

SMILES

CC(C)COC1=CC(F)=CC(=C1)C2=NC(N3C[C@@H](C)CC3(C)C)=C(C=C2)C(=O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChIKey=NHOUNZMCSIHKHJ-FQEVSTJZSA-N
InChI=1S/C29H34FN3O4S/c1-19(2)18-37-23-14-21(13-22(30)15-23)26-12-11-25(27(31-26)33-17-20(3)16-29(33,4)5)28(34)32-38(35,36)24-9-7-6-8-10-24/h6-15,19-20H,16-18H2,1-5H3,(H,32,34)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H34FN3O4S
Molecular Weight 539.661
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Oct 22 01:23:32 UTC 2019
Edited
by admin
on Tue Oct 22 01:23:32 UTC 2019
Record UNII
RZ7027HK8F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OLACAFTOR
INN   USAN  
Official Name English
6-(3-FLUORO-5-(2-METHYLPROPOXY)PHENYL)-N-(PHENYLSULFONYL)-2-((4S)-2,2,4-TRIMETHYLPYRROLIDIN-1-YL)PYRIDINE-3-CARBOXAMIDE
Systematic Name English
OLACAFTOR [INN]
Common Name English
VX-440
Code English
OLACAFTOR [USAN]
Common Name English
3-PYRIDINECARBOXAMIDE, 6-(3-FLUORO-5-(2-METHYLPROPOXY)PHENYL)-N-(PHENYLSULFONYL)-2-((4S)-2,2,4-TRIMETHYL-1-PYRROLIDINYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
121250885
Created by admin on Tue Oct 22 01:23:32 UTC 2019 , Edited by admin on Tue Oct 22 01:23:32 UTC 2019
PRIMARY
CAS
1897384-89-2
Created by admin on Tue Oct 22 01:23:32 UTC 2019 , Edited by admin on Tue Oct 22 01:23:32 UTC 2019
PRIMARY
INN
10886
Created by admin on Tue Oct 22 01:23:32 UTC 2019 , Edited by admin on Tue Oct 22 01:23:32 UTC 2019
PRIMARY
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