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Details

Stereochemistry ACHIRAL
Molecular Formula C27H20ClN3O2
Molecular Weight 453.9205
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VODOBATINIB

SMILES

Cc1ccc(cc1C#Cc2cc3ccccc3nc2)C(=O)NN=C(c4c(C)cccc4Cl)O

InChI

InChIKey=ZQOBVMHBVWNVBG-UHFFFAOYSA-N
InChI=1S/C27H20ClN3O2/c1-17-10-12-22(26(32)30-31-27(33)25-18(2)6-5-8-23(25)28)15-20(17)13-11-19-14-21-7-3-4-9-24(21)29-16-19/h3-10,12,14-16H,1-2H3,(H,30,32)(H,31,33)

HIDE SMILES / InChI

Molecular Formula C27H20ClN3O2
Molecular Weight 453.9205
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 Jun 25 22:36:48 UTC 2021
Edited
by admin
on Fri Jun 25 22:36:48 UTC 2021
Record UNII
N8Q12KU2SW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VODOBATINIB
INN   USAN  
Official Name English
4-METHYL-3-QUINOLIN-3-YL-ETHYNYL BENZOIC ACID N'-(2-CHLORO-6-METHYLBENZOYL)HYDRAZIDE
Systematic Name English
BENZOIC ACID, 2-CHLORO-6-METHYL-, 2-(4-METHYL-3-(2-(3-QUINOLINYL)ETHYNYL)BENZOYL)HYDRAZIDE
Systematic Name English
VODOBATINIB [USAN]
Common Name English
2-CHLORO-6-METHYL-N'-(4-METHYL-3-(2-(QUINOLIN-3-YL)ETHYNYL)BENZOYL)BENZOHYDRAZIDE
Systematic Name English
4-METHYL-3-QUINOLIN-3-YLETHYNYLBENZOIC ACID N'-(2-CHLORO-6-METHYLBENZOYL) HYDRAZIDE
Systematic Name English
VODOBATINIB [INN]
Common Name English
K0706
Code English
SCO-088
Common Name English
K-0706
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 687119
Created by admin on Fri Jun 25 22:36:48 UTC 2021 , Edited by admin on Fri Jun 25 22:36:48 UTC 2021
Code System Code Type Description
FDA UNII
N8Q12KU2SW
Created by admin on Fri Jun 25 22:36:48 UTC 2021 , Edited by admin on Fri Jun 25 22:36:48 UTC 2021
PRIMARY
CAS
1388803-90-4
Created by admin on Fri Jun 25 22:36:48 UTC 2021 , Edited by admin on Fri Jun 25 22:36:48 UTC 2021
PRIMARY
INN
11506
Created by admin on Fri Jun 25 22:36:48 UTC 2021 , Edited by admin on Fri Jun 25 22:36:48 UTC 2021
PRIMARY
PUBCHEM
89884852
Created by admin on Fri Jun 25 22:36:48 UTC 2021 , Edited by admin on Fri Jun 25 22:36:48 UTC 2021
PRIMARY
NCI_THESAURUS
C174748
Created by admin on Fri Jun 25 22:36:48 UTC 2021 , Edited by admin on Fri Jun 25 22:36:48 UTC 2021
PRIMARY
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