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Details

Stereochemistry ACHIRAL
Molecular Formula C20H12ClF3N5O3S.Na
Molecular Weight 517.844
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ILACIRNON SODIUM

SMILES

[Na+].CC1=CC([N-]S(=O)(=O)C2=CC=C(Cl)C(=C2)C(F)(F)F)=C(N=C1)C(=O)C3=C4C=CNC4=NC=N3

InChI

InChIKey=GJTHOZVZZCTXOH-UHFFFAOYSA-M
InChI=1S/C20H13ClF3N5O3S.Na/c1-10-6-15(29-33(31,32)11-2-3-14(21)13(7-11)20(22,23)24)17(26-8-10)18(30)16-12-4-5-25-19(12)28-9-27-16;/h2-9H,1H3,(H2,25,27,28,29,30);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
2.3 nM [Kd]
Name Type Language
ILACIRNON SODIUM
USAN  
Official Name English
ILACIRNON SODIUM [USAN]
Common Name English
BENZENESULFONAMIDE, 4-CHLORO-N-(5-METHYL-2-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YLCARBONYL)-3-PYRIDINYL)-3-(TRIFLUOROMETHYL)-, SODIUM SALT (1:1)
Common Name English
CCX-140 SODIUM
Code English
4-CHLORO-N-(5-METHYL-2-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YLCARBONYL)-3-PYRIDINYL)-3-(TRIFLUOROMETHYL)BENZENESULFONAMIDE, SODIUM SALT
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 604317
Created by admin on Sat Dec 16 08:10:48 GMT 2023 , Edited by admin on Sat Dec 16 08:10:48 GMT 2023
Code System Code Type Description
FDA UNII
X39CM70JTQ
Created by admin on Sat Dec 16 08:10:48 GMT 2023 , Edited by admin on Sat Dec 16 08:10:48 GMT 2023
PRIMARY
PUBCHEM
137552094
Created by admin on Sat Dec 16 08:10:48 GMT 2023 , Edited by admin on Sat Dec 16 08:10:48 GMT 2023
PRIMARY
USAN
JK-58
Created by admin on Sat Dec 16 08:10:48 GMT 2023 , Edited by admin on Sat Dec 16 08:10:48 GMT 2023
PRIMARY
NCI_THESAURUS
C180646
Created by admin on Sat Dec 16 08:10:48 GMT 2023 , Edited by admin on Sat Dec 16 08:10:48 GMT 2023
PRIMARY
CAS
1100319-36-5
Created by admin on Sat Dec 16 08:10:48 GMT 2023 , Edited by admin on Sat Dec 16 08:10:48 GMT 2023
PRIMARY
SMS_ID
300000044590
Created by admin on Sat Dec 16 08:10:48 GMT 2023 , Edited by admin on Sat Dec 16 08:10:48 GMT 2023
PRIMARY