U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H18ClF2N5O3.ClH
Molecular Weight 486.299
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ASCIMINIB HYDROCHLORIDE

SMILES

Cl.O[C@@H]1CCN(C1)C2=C(C=C(C=N2)C(=O)NC3=CC=C(OC(F)(F)Cl)C=C3)C4=CC=NN4

InChI

InChIKey=HGCOOPLEWPBLOY-PFEQFJNWSA-N
InChI=1S/C20H18ClF2N5O3.ClH/c21-20(22,23)31-15-3-1-13(2-4-15)26-19(30)12-9-16(17-5-7-25-27-17)18(24-10-12)28-8-6-14(29)11-28;/h1-5,7,9-10,14,29H,6,8,11H2,(H,25,27)(H,26,30);1H/t14-;/m1./s1

HIDE SMILES / InChI

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

Molecular Formula C20H18ClF2N5O3
Molecular Weight 449.838
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:44:59 UTC 2023
Edited
by admin
on Sat Dec 16 14:44:59 UTC 2023
Record UNII
C5U34S9XFV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ASCIMINIB HYDROCHLORIDE
USAN  
Official Name English
ASCIMINIB HYDROCHLORIDE [USAN]
Common Name English
ASCIMINIB HYDROCHLORIDE [JAN]
Common Name English
ABL001-AAA
Code English
Asciminib hydrochloride [WHO-DD]
Common Name English
ASCIMINIB HYDROCHLORIDE [ORANGE BOOK]
Common Name English
SCEMBLIX
Brand Name English
Code System Code Type Description
SMS_ID
300000011169
Created by admin on Sat Dec 16 14:44:59 UTC 2023 , Edited by admin on Sat Dec 16 14:44:59 UTC 2023
PRIMARY
USAN
FG-585
Created by admin on Sat Dec 16 14:44:59 UTC 2023 , Edited by admin on Sat Dec 16 14:44:59 UTC 2023
PRIMARY
FDA UNII
C5U34S9XFV
Created by admin on Sat Dec 16 14:44:59 UTC 2023 , Edited by admin on Sat Dec 16 14:44:59 UTC 2023
PRIMARY
DAILYMED
C5U34S9XFV
Created by admin on Sat Dec 16 14:44:59 UTC 2023 , Edited by admin on Sat Dec 16 14:44:59 UTC 2023
PRIMARY
RXCUI
2584303
Created by admin on Sat Dec 16 14:44:59 UTC 2023 , Edited by admin on Sat Dec 16 14:44:59 UTC 2023
PRIMARY
PUBCHEM
133082086
Created by admin on Sat Dec 16 14:44:59 UTC 2023 , Edited by admin on Sat Dec 16 14:44:59 UTC 2023
PRIMARY
NCI_THESAURUS
C171722
Created by admin on Sat Dec 16 14:44:59 UTC 2023 , Edited by admin on Sat Dec 16 14:44:59 UTC 2023
PRIMARY
CAS
2119669-71-3
Created by admin on Sat Dec 16 14:44:59 UTC 2023 , Edited by admin on Sat Dec 16 14:44:59 UTC 2023
PRIMARY
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