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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H27Cl2N5O6S
Molecular Weight 548.44
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AZD-5099

SMILES

COC[C@H](C)NC(=O)C1=C(SC(=N1)N2CC[C@@H](NC(=O)C3=C(Cl)C(Cl)=C(C)N3)[C@H](C2)OC)C(O)=O

InChI

InChIKey=KGZHRAVDXGQUQM-WCQGTBRESA-N
InChI=1S/C21H27Cl2N5O6S/c1-9(8-33-3)24-19(30)16-17(20(31)32)35-21(27-16)28-6-5-11(12(7-28)34-4)26-18(29)15-14(23)13(22)10(2)25-15/h9,11-12,25H,5-8H2,1-4H3,(H,24,30)(H,26,29)(H,31,32)/t9-,11+,12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H27Cl2N5O6S
Molecular Weight 548.44
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:42:12 UTC 2023
Edited
by admin
on Sat Dec 16 01:42:12 UTC 2023
Record UNII
33BLU33GDV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AZD-5099
Code English
5-THIAZOLECARBOXYLIC ACID, 2-((3S,4R)-4-(((3,4-DICHLORO-5-METHYL-1H-PYRROL-2-YL)CARBONYL)AMINO)-3-METHOXY-1-PIPERIDINYL)-4-((((1S)-2-METHOXY-1-METHYLETHYL)AMINO)CARBONYL)-
Systematic Name English
AZD 5099 [WHO-DD]
Common Name English
AZD5099
Code English
Code System Code Type Description
PUBCHEM
11995990
Created by admin on Sat Dec 16 01:42:13 UTC 2023 , Edited by admin on Sat Dec 16 01:42:13 UTC 2023
PRIMARY
CAS
907543-25-3
Created by admin on Sat Dec 16 01:42:13 UTC 2023 , Edited by admin on Sat Dec 16 01:42:13 UTC 2023
PRIMARY
FDA UNII
33BLU33GDV
Created by admin on Sat Dec 16 01:42:13 UTC 2023 , Edited by admin on Sat Dec 16 01:42:13 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
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ACTIVE MOIETY