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Details

Stereochemistry ACHIRAL
Molecular Formula C24H18ClF3N6O4S.C7H8O3S
Molecular Weight 751.152
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ONO-7579 TOSYLATE

SMILES

CC1=CC=C(C=C1)S(O)(=O)=O.CS(=O)(=O)C2=CC=C(C=C2NC(=O)NC3=CN=C(OC4=CC=C(C=C4)C5=CC(Cl)=CN=C5N)N=C3)C(F)(F)F

InChI

InChIKey=ZJRVPHBSCBUDBI-UHFFFAOYSA-N
InChI=1S/C24H18ClF3N6O4S.C7H8O3S/c1-39(36,37)20-7-4-14(24(26,27)28)8-19(20)34-22(35)33-16-11-31-23(32-12-16)38-17-5-2-13(3-6-17)18-9-15(25)10-30-21(18)29;1-6-2-4-7(5-3-6)11(8,9)10/h2-12H,1H3,(H2,29,30)(H2,33,34,35);2-5H,1H3,(H,8,9,10)

HIDE SMILES / InChI

Molecular Formula C24H18ClF3N6O4S
Molecular Weight 578.951
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H8O3S
Molecular Weight 172.202
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 13:22:34 GMT 2023
Edited
by admin
on Sat Dec 16 13:22:34 GMT 2023
Record UNII
1C01KML96K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ONO-7579 TOSYLATE
Code English
N-{2-[4-(2-Amino-5-chloropyridin-3-yl)phenoxy]pyrimidin-5-yl}-N'-[2-(methanesulfonyl)-5-(trifluoromethyl)phenyl]urea mono-4-toluenesulfonate
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 599717
Created by admin on Sat Dec 16 13:22:34 GMT 2023 , Edited by admin on Sat Dec 16 13:22:34 GMT 2023
Code System Code Type Description
PUBCHEM
129274931
Created by admin on Sat Dec 16 13:22:34 GMT 2023 , Edited by admin on Sat Dec 16 13:22:34 GMT 2023
PRIMARY
FDA UNII
1C01KML96K
Created by admin on Sat Dec 16 13:22:34 GMT 2023 , Edited by admin on Sat Dec 16 13:22:34 GMT 2023
PRIMARY
CAS
1879938-50-7
Created by admin on Sat Dec 16 13:22:34 GMT 2023 , Edited by admin on Sat Dec 16 13:22:34 GMT 2023
PRIMARY
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