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Details

Stereochemistry ACHIRAL
Molecular Formula C28H21ClF3N7O
Molecular Weight 563.961
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-[[5-Chloro-4-(3-pyridinyl)-2-pyrimidinyl]amino]-4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide

SMILES

CC1=CN(C=N1)C2=CC(=CC(NC(=O)C3=CC(NC4=NC=C(Cl)C(=N4)C5=CN=CC=C5)=C(C)C=C3)=C2)C(F)(F)F

InChI

InChIKey=KGPBKNJEPLSFIW-UHFFFAOYSA-N
InChI=1S/C28H21ClF3N7O/c1-16-5-6-18(8-24(16)37-27-34-13-23(29)25(38-27)19-4-3-7-33-12-19)26(40)36-21-9-20(28(30,31)32)10-22(11-21)39-14-17(2)35-15-39/h3-15H,1-2H3,(H,36,40)(H,34,37,38)

HIDE SMILES / InChI

Molecular Formula C28H21ClF3N7O
Molecular Weight 563.961
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 19:29:36 GMT 2023
Edited
by admin
on Sat Dec 16 19:29:36 GMT 2023
Record UNII
KD75MMQ7LZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-[[5-Chloro-4-(3-pyridinyl)-2-pyrimidinyl]amino]-4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide
Systematic Name English
Benzamide, 3-[[5-chloro-4-(3-pyridinyl)-2-pyrimidinyl]amino]-4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-
Systematic Name English
Code System Code Type Description
PUBCHEM
145875085
Created by admin on Sat Dec 16 19:29:36 GMT 2023 , Edited by admin on Sat Dec 16 19:29:36 GMT 2023
PRIMARY
FDA UNII
KD75MMQ7LZ
Created by admin on Sat Dec 16 19:29:36 GMT 2023 , Edited by admin on Sat Dec 16 19:29:36 GMT 2023
PRIMARY
CAS
2469039-94-7
Created by admin on Sat Dec 16 19:29:36 GMT 2023 , Edited by admin on Sat Dec 16 19:29:36 GMT 2023
PRIMARY
Related Record Type Details
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