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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H15Cl2FN4O3S
Molecular Weight 421.274
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AZD-1279

SMILES

CC1=C(Cl)C(Cl)=C(N1)C(=O)N[C@@H]2CCN(C[C@@H]2F)C3=NC=C(S3)C(O)=O

InChI

InChIKey=BGDGHNSKANYMHF-JGVFFNPUSA-N
InChI=1S/C15H15Cl2FN4O3S/c1-6-10(16)11(17)12(20-6)13(23)21-8-2-3-22(5-7(8)18)15-19-4-9(26-15)14(24)25/h4,7-8,20H,2-3,5H2,1H3,(H,21,23)(H,24,25)/t7-,8+/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H15Cl2FN4O3S
Molecular Weight 421.274
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:17:32 GMT 2023
Edited
by admin
on Sat Dec 16 19:17:32 GMT 2023
Record UNII
2R724K4NN4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AZD-1279
Code English
AZD1279
Code English
AZD 1279 [WHO-DD]
Common Name English
5-Thiazolecarboxylic acid, 2-[(3S,4R)-4-[[(3,4-dichloro-5-methyl-1H-pyrrol-2-yl)carbonyl]amino]-3-fluoro-1-piperidinyl]-
Systematic Name English
2-[(3S,4R)-4-[[(3,4-Dichloro-5-methyl-1H-pyrrol-2-yl)carbonyl]amino]-3-fluoro-1-piperidinyl]-5-thiazolecarboxylic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
11718729
Created by admin on Sat Dec 16 19:17:32 GMT 2023 , Edited by admin on Sat Dec 16 19:17:32 GMT 2023
PRIMARY
CAS
907539-79-1
Created by admin on Sat Dec 16 19:17:32 GMT 2023 , Edited by admin on Sat Dec 16 19:17:32 GMT 2023
PRIMARY
FDA UNII
2R724K4NN4
Created by admin on Sat Dec 16 19:17:32 GMT 2023 , Edited by admin on Sat Dec 16 19:17:32 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY