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Details

Stereochemistry ACHIRAL
Molecular Formula C26H22FN7O.ClH
Molecular Weight 503.959
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of AG-13958 MONOHYDROCHLORIDE

SMILES

Cl.CN1N=C(C)C=C1C(=O)NC2=CC(NC3=CC=C4C(NN=C4\C=C\C5=NC=CC=C5)=C3)=CC=C2F

InChI

InChIKey=BRTPJWBYMBBEHE-YGCVIUNWSA-N
InChI=1S/C26H22FN7O.ClH/c1-16-13-25(34(2)33-16)26(35)30-24-15-19(7-10-21(24)27)29-18-6-9-20-22(31-32-23(20)14-18)11-8-17-5-3-4-12-28-17;/h3-15,29H,1-2H3,(H,30,35)(H,31,32);1H/b11-8+;

HIDE SMILES / InChI

Approval Year

Name Type Language
AG-13958 MONOHYDROCHLORIDE
Common Name English
1H-PYRAZOLE-5-CARBOXAMIDE, N-(2-FLUORO-5-((3-((1E)-2-(2-PYRIDINYL)ETHENYL)-1H-INDAZOL-6-YL)AMINO)PHENYL)-1,3-DIMETHYL-, MONOHYDROCHLORIDE
Systematic Name English
N-(2-FLUORO-5-((3-((E)-2-(2-PYRIDYL)VINYL)-1H-INDAZOL-6-YL)AMINO)PHENYL)-2,5-DIMETHYL-PYRAZOLE-3-CARBOXAMIDE, HYDROCHLORIDE
Systematic Name English
1H-PYRAZOLE-5-CARBOXAMIDE, N-(2-FLUORO-5-((3-((1E)-2-(2-PYRIDINYL)ETHENYL)-1H-INDAZOL-6-YL)AMINO)PHENYL)-1,3-DIMETHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
69372072
Created by admin on Sat Dec 16 12:12:53 UTC 2023 , Edited by admin on Sat Dec 16 12:12:53 UTC 2023
PRIMARY
FDA UNII
21L6K9UC1U
Created by admin on Sat Dec 16 12:12:53 UTC 2023 , Edited by admin on Sat Dec 16 12:12:53 UTC 2023
PRIMARY
CAS
319463-49-5
Created by admin on Sat Dec 16 12:12:53 UTC 2023 , Edited by admin on Sat Dec 16 12:12:53 UTC 2023
PRIMARY