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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H18ClF5N4O4
Molecular Weight 520.837
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ORLUDODSTAT

SMILES

CCN1C(=O)N(N=C1CO)C2=CC(O[C@@H](C)C(F)(F)F)=C(C=C2F)C(=O)NC3=C(F)C=CC=C3Cl

InChI

InChIKey=KNVJMHHAXCPZHF-JTQLQIEISA-N
InChI=1S/C21H18ClF5N4O4/c1-3-30-17(9-32)29-31(20(30)34)15-8-16(35-10(2)21(25,26)27)11(7-14(15)24)19(33)28-18-12(22)5-4-6-13(18)23/h4-8,10,32H,3,9H2,1-2H3,(H,28,33)/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H18ClF5N4O4
Molecular Weight 520.837
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 14:20:53 UTC 2023
Edited
by admin
on Sat Dec 16 14:20:53 UTC 2023
Record UNII
X8GF945GMK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ORLUDODSTAT
INN  
Official Name English
BAY-2402234
Code English
BAY 2402234 [WHO-DD]
Common Name English
N-(2-CHLORO-6-FLUOROPHENYL)-4-(4-ETHYL-3-(HYDROXYMETHYL)-5-OXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-1-YL)-5-FLUORO-2-(((2S)-1,1,1-TRIFLUOROPROPAN-2-YL)OXY)BENZAMIDE
Systematic Name English
ORLUDODSTAT(INN)
Common Name English
BENZAMIDE, N-(2-CHLORO-6-FLUOROPHENYL)-4-(4-ETHYL-4,5-DIHYDRO-3-(HYDROXYMETHYL)-5-OXO-1H-1,2,4-TRIAZOL-1-YL)-5-FLUORO-2-((1S)-2,2,2-TRIFLUORO-1-METHYLETHOXY)-
Systematic Name English
N-(2-CHLORO-6-FLUOROPHENYL)-4-(4-ETHYL-4,5-DIHYDRO-3-(HYDROXYMETHYL)-5-OXO-1H-1,2,4-TRIAZOL-1-YL)-5-FLUORO-2-((1S)-2,2,2-TRIFLUORO-1-METHYLETHOXY)BENZAMIDE
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C153137
Created by admin on Sat Dec 16 14:20:53 UTC 2023 , Edited by admin on Sat Dec 16 14:20:53 UTC 2023
PRIMARY
SMS_ID
300000032235
Created by admin on Sat Dec 16 14:20:53 UTC 2023 , Edited by admin on Sat Dec 16 14:20:53 UTC 2023
PRIMARY
PUBCHEM
134470179
Created by admin on Sat Dec 16 14:20:53 UTC 2023 , Edited by admin on Sat Dec 16 14:20:53 UTC 2023
PRIMARY
INN
11644
Created by admin on Sat Dec 16 14:20:53 UTC 2023 , Edited by admin on Sat Dec 16 14:20:53 UTC 2023
PRIMARY INN
CAS
2225819-06-5
Created by admin on Sat Dec 16 14:20:53 UTC 2023 , Edited by admin on Sat Dec 16 14:20:53 UTC 2023
PRIMARY
FDA UNII
X8GF945GMK
Created by admin on Sat Dec 16 14:20:53 UTC 2023 , Edited by admin on Sat Dec 16 14:20:53 UTC 2023
PRIMARY
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TARGET -> INHIBITOR
IC50
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