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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H22F2N6O2.ClH
Molecular Weight 464.896
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Larotrectinib hydrochloride

SMILES

Cl.[H][C@@]1(CCCN1C2=NC3=C(NC(=O)N4CC[C@H](O)C4)C=NN3C=C2)C5=C(F)C=CC(F)=C5

InChI

InChIKey=UIHKJNYGFOAQDS-QLOBERJESA-N
InChI=1S/C21H22F2N6O2.ClH/c22-13-3-4-16(23)15(10-13)18-2-1-7-28(18)19-6-9-29-20(26-19)17(11-24-29)25-21(31)27-8-5-14(30)12-27;/h3-4,6,9-11,14,18,30H,1-2,5,7-8,12H2,(H,25,31);1H/t14-,18+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C21H22F2N6O2
Molecular Weight 428.4352
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
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 19:32:10 UTC 2023
Edited
by admin
on Sat Dec 16 19:32:10 UTC 2023
Record UNII
E4BVS4JUA7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Larotrectinib hydrochloride
Common Name English
1-Pyrrolidinecarboxamide, N-[5-[(2R)-2-(2,5-difluorophenyl)-1-pyrrolidinyl]pyrazolo[1,5-a]pyrimidin-3-yl]-3-hydroxy-, hydrochloride (1:1), (3S)-
Systematic Name English
Code System Code Type Description
FDA UNII
E4BVS4JUA7
Created by admin on Sat Dec 16 19:32:10 UTC 2023 , Edited by admin on Sat Dec 16 19:32:10 UTC 2023
PRIMARY
CAS
1919868-83-9
Created by admin on Sat Dec 16 19:32:10 UTC 2023 , Edited by admin on Sat Dec 16 19:32:10 UTC 2023
PRIMARY
PUBCHEM
121333501
Created by admin on Sat Dec 16 19:32:10 UTC 2023 , Edited by admin on Sat Dec 16 19:32:10 UTC 2023
PRIMARY
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