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

Details

Stereochemistry ACHIRAL
Molecular Formula C30H28FN7O3.C7H8O3S
Molecular Weight 725.788
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of REBASTINIB TOSYLATE

SMILES

CC1=CC=C(C=C1)S(O)(=O)=O.CNC(=O)C2=NC=CC(OC3=CC=C(NC(=O)NC4=CC(=NN4C5=CC=C6N=CC=CC6=C5)C(C)(C)C)C(F)=C3)=C2

InChI

InChIKey=ARPBZBAWXAVDCE-UHFFFAOYSA-N
InChI=1S/C30H28FN7O3.C7H8O3S/c1-30(2,3)26-17-27(38(37-26)19-7-9-23-18(14-19)6-5-12-33-23)36-29(40)35-24-10-8-20(15-22(24)31)41-21-11-13-34-25(16-21)28(39)32-4;1-6-2-4-7(5-3-6)11(8,9)10/h5-17H,1-4H3,(H,32,39)(H2,35,36,40);2-5H,1H3,(H,8,9,10)

HIDE SMILES / InChI

Approval Year

Name Type Language
REBASTINIB TOSYLATE
USAN  
USAN  
Official Name English
Rebastinib tosilate [WHO-DD]
Common Name English
REBASTINIB TOSILATE
WHO-DD  
Common Name English
2-PYRIDINECARBOXAMIDE, 4-(4-((((3-(1,1-DIMETHYLETHYL)-1-(6-QUINOLINYL)-1H-PYRAZOL-5-YL)AMINO)CARBONYL)AMINO)-3-FLUOROPHENOXY)-N-METHYL-, 4-METHYLBENZENESULFONATE (1:1)
Common Name English
REBASTINIB TOSYLATE [USAN]
Common Name English
N-(3-(1,1-DIMETHYLETHYL)-1-(QUINOLIN-6-YL)-1H-PYRAZOL-5-YL)-N'-(2-FLUORO-4-((2-(METHYLCARBAMOYL)PYRIDIN-4-YL)OXY)PHENYL)UREA MONO(4-METHYLBENZENESULFONATE)
Common Name English
DCC-2036
Code English
DP-1919.TO
Code English
Classification Tree Code System Code
NCI_THESAURUS C1967
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
NCI_THESAURUS C129825
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
FDA ORPHAN DRUG 290509
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
Code System Code Type Description
CAS
1033893-29-6
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
PRIMARY
DRUG BANK
DBSALT002929
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
PRIMARY
USAN
ZZ-64
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
PRIMARY
PUBCHEM
57409360
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
PRIMARY
ChEMBL
CHEMBL1738757
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
PRIMARY
FDA UNII
042A5NJE6B
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
PRIMARY
EPA CompTox
DTXSID40145808
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
PRIMARY
SMS_ID
300000044492
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
PRIMARY
NCI_THESAURUS
C82693
Created by admin on Sat Dec 16 01:28:35 UTC 2023 , Edited by admin on Sat Dec 16 01:28:35 UTC 2023
PRIMARY