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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H20Cl2N2O3
Molecular Weight 467.344
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EMVODODSTAT

SMILES

COC1=CC=C(C=C1)[C@@H]2N(CCC3=C2NC4=C3C=C(Cl)C=C4)C(=O)OC5=CC=C(Cl)C=C5

InChI

InChIKey=SRSHBZRURUNOSM-DEOSSOPVSA-N
InChI=1S/C25H20Cl2N2O3/c1-31-18-7-2-15(3-8-18)24-23-20(21-14-17(27)6-11-22(21)28-23)12-13-29(24)25(30)32-19-9-4-16(26)5-10-19/h2-11,14,24,28H,12-13H2,1H3/t24-/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H20Cl2N2O3
Molecular Weight 467.344
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:34:45 GMT 2023
Edited
by admin
on Sat Dec 16 08:34:45 GMT 2023
Record UNII
053QD2I96A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EMVODODSTAT
USAN   INN  
Official Name English
PTC-299
Common Name English
4-CHLOROPHENYL (1S)-6-CHLORO-1-(4-METHOXYPHENYL)-1,3,4,9-TETRAHYDRO-2H-PYRIDO(3,4-B)INDOLE-2-CARBOXYLATE
Systematic Name English
EMVODODSTAT [USAN]
Common Name English
Emvododstat [WHO-DD]
Common Name English
2H-PYRIDO(3,4-B)INDOLE-2-CARBOXYLIC ACID, 6-CHLORO-1,3,4,9-TETRAHYDRO-1-(4-METHOXYPHENYL)-, 4-CHLOROPHENYL ESTER, (1S)-
Common Name English
emvododstat [INN]
Common Name English
PTC299
Code English
Classification Tree Code System Code
FDA ORPHAN DRUG 720919
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
Code System Code Type Description
DRUG BANK
DB05173
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
PRIMARY
USAN
HI-74
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
PRIMARY
INN
11614
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
PRIMARY
SMS_ID
300000019251
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
PRIMARY
CAS
1219951-09-3
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
SUPERSEDED
NCI_THESAURUS
C91100
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
PRIMARY
PUBCHEM
49787172
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
PRIMARY
FDA UNII
053QD2I96A
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
PRIMARY
CAS
1256565-36-2
Created by admin on Sat Dec 16 08:34:45 GMT 2023 , Edited by admin on Sat Dec 16 08:34:45 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY