U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C26H34F3N7O4S
Molecular Weight 597.653
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ELEXACAFTOR

SMILES

C[C@@H]1CN(C2=NC(=CC=C2C(=O)NS(=O)(=O)C3=CN(C)N=C3C)N4C=CC(OCC(C)(C)C(F)(F)F)=N4)C(C)(C)C1

InChI

InChIKey=MVRHVFSOIWFBTE-INIZCTEOSA-N
InChI=1S/C26H34F3N7O4S/c1-16-12-25(5,6)35(13-16)22-18(23(37)33-41(38,39)19-14-34(7)31-17(19)2)8-9-20(30-22)36-11-10-21(32-36)40-15-24(3,4)26(27,28)29/h8-11,14,16H,12-13,15H2,1-7H3,(H,33,37)/t16-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ELEXACAFTOR
USAN   INN  
Official Name English
Elexacaftor [WHO-DD]
Common Name English
ELEXACAFTOR [USAN]
Common Name English
ELEXACAFTOR [MI]
Common Name English
VX-445
Code English
N-(1,3-Dimethyl-1H-pyrazole-4-sulfonyl)-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)-1H-pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
Systematic Name English
elexacaftor [INN]
Common Name English
3-PYRIDINECARBOXAMIDE, N-((1,3-DIMETHYL-1H-PYRAZOL-4-YL)SULFONYL)-6-(3-(3,3,3-TRIFLUORO-2,2-DIMETHYLPROPOXY)-1H-PYRAZOL-1-YL)-2-((4S)-2,2,4-TRIMETHYL-1-PYRROLIDINYL)-
Code English
TRIKAFTA COMPONENT ELEXACAFTOR
Brand Name English
ELEXACAFTOR COMPONENT OF TRIKAFTA
Brand Name English
ELEXACAFTOR [ORANGE BOOK]
Common Name English
Classification Tree Code System Code
EU-Orphan Drug EU/3/18/2116
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
FDA ORPHAN DRUG 647618
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID901027907
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
DRUG BANK
DB15444
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
DAILYMED
RRN67GMB0V
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
PUBCHEM
134587348
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
RXCUI
2256951
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
USAN
FG-200
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
INN
11180
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
SMS_ID
100000177684
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
FDA UNII
RRN67GMB0V
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
DRUG CENTRAL
5372
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
CAS
2216712-66-0
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
MERCK INDEX
m12166
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
LACTMED
Elexacaftor, Tezacaftor and Ivacaftor
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
NCI_THESAURUS
C169935
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY
WIKIPEDIA
Elexacaftor
Created by admin on Sat Dec 16 13:22:36 GMT 2023 , Edited by admin on Sat Dec 16 13:22:36 GMT 2023
PRIMARY