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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H22N6O2.2ClH
Molecular Weight 487.382
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Momelotinib Dihydrochloride

SMILES

Cl.Cl.O=C(NCC#N)C1=CC=C(C=C1)C2=NC(NC3=CC=C(C=C3)N4CCOCC4)=NC=C2

InChI

InChIKey=IPNATXQRPWRHKD-UHFFFAOYSA-N
InChI=1S/C23H22N6O2.2ClH/c24-10-12-25-22(30)18-3-1-17(2-4-18)21-9-11-26-23(28-21)27-19-5-7-20(8-6-19)29-13-15-31-16-14-29;;/h1-9,11H,12-16H2,(H,25,30)(H,26,27,28);2*1H

HIDE SMILES / InChI

Molecular Formula C23H22N6O2
Molecular Weight 414.4598
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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 Fri Dec 15 16:54:58 UTC 2023
Edited
by admin
on Fri Dec 15 16:54:58 UTC 2023
Record UNII
RBH995N496
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Momelotinib Dihydrochloride
USAN   WHO-DD  
USAN  
Official Name English
MOMELOTINIB DIHYDROCHLORIDE [USAN]
Common Name English
CYT-387 DIHYDROCHLORIDE
Code English
Momelotinib dihydrochloride [WHO-DD]
Common Name English
BENZAMIDE, N-(CYANOMETHYL)-4-(2-((4-(4-MORPHOLINYL)PHENYL)AMINO)-4-PYRIMIDINYL)-, HYDROCHLORIDE (1:2)
Systematic Name English
BENZAMIDE, N-(CYANOMETHYL)-4-(2-((4-(4-MORPHOLINYL)PHENYL)AMINO)-4-PYRIMIDINYL)-, DIHYDROCHLORIDE
Common Name English
CYT387 DIHYDROCHLORIDE
Code English
Classification Tree Code System Code
EU-Orphan Drug EU/3/11/888
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
EU-Orphan Drug EU/3/11/888
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
Code System Code Type Description
FDA UNII
RBH995N496
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
PRIMARY
USAN
ZZ-109
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
PRIMARY
SMS_ID
100000184152
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
PRIMARY
PUBCHEM
57345482
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
PRIMARY
NCI_THESAURUS
C170191
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
PRIMARY
CAS
1380317-28-1
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
PRIMARY
ChEMBL
CHEMBL1078178
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
PRIMARY
EPA CompTox
DTXSID00160456
Created by admin on Fri Dec 15 16:54:58 UTC 2023 , Edited by admin on Fri Dec 15 16:54:58 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY