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

Details

Stereochemistry ACHIRAL
Molecular Formula C25H25Cl2F3N4O4S
Molecular Weight 605.457
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AZD-2207

SMILES

CC1=C(N=C(N1C2=CC=C(OS(=O)(=O)CCC(F)(F)F)C=C2)C3=C(Cl)C=C(Cl)C=C3)C(=O)NN4CCCCC4

InChI

InChIKey=NHIXRYPUVCFFAF-UHFFFAOYSA-N
InChI=1S/C25H25Cl2F3N4O4S/c1-16-22(24(35)32-33-12-3-2-4-13-33)31-23(20-10-5-17(26)15-21(20)27)34(16)18-6-8-19(9-7-18)38-39(36,37)14-11-25(28,29)30/h5-10,15H,2-4,11-14H2,1H3,(H,32,35)

HIDE SMILES / InChI

Molecular Formula C25H25Cl2F3N4O4S
Molecular Weight 605.457
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:03:55 GMT 2023
Edited
by admin
on Sat Dec 16 15:03:55 GMT 2023
Record UNII
9ZI8H1XB9X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AZD-2207
Code English
AZD 2207 [WHO-DD]
Common Name English
1-PROPANESULFONIC ACID, 3,3,3-TRIFLUORO-, 4-(2-(2,4-DICHLOROPHENYL)-5-METHYL-4-((1-PIPERIDINYLAMINO)CARBONYL)-1H-IMIDAZOL-1-YL)PHENYL ESTER
Systematic Name English
Code System Code Type Description
CAS
866598-45-0
Created by admin on Sat Dec 16 15:03:55 GMT 2023 , Edited by admin on Sat Dec 16 15:03:55 GMT 2023
PRIMARY
FDA UNII
9ZI8H1XB9X
Created by admin on Sat Dec 16 15:03:55 GMT 2023 , Edited by admin on Sat Dec 16 15:03:55 GMT 2023
PRIMARY
CAS
1207892-86-1
Created by admin on Sat Dec 16 15:03:55 GMT 2023 , Edited by admin on Sat Dec 16 15:03:55 GMT 2023
ALTERNATIVE
PUBCHEM
11548933
Created by admin on Sat Dec 16 15:03:55 GMT 2023 , Edited by admin on Sat Dec 16 15:03:55 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT