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Details

Stereochemistry ACHIRAL
Molecular Formula C30H23N5O
Molecular Weight 469.5365
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DACTOLISIB

SMILES

CN1C(=O)N(C2=C1C=NC3=CC=C(C=C23)C4=CN=C5C=CC=CC5=C4)C6=CC=C(C=C6)C(C)(C)C#N

InChI

InChIKey=JOGKUKXHTYWRGZ-UHFFFAOYSA-N
InChI=1S/C30H23N5O/c1-30(2,18-31)22-9-11-23(12-10-22)35-28-24-15-19(21-14-20-6-4-5-7-25(20)32-16-21)8-13-26(24)33-17-27(28)34(3)29(35)36/h4-17H,1-3H3

HIDE SMILES / InChI
Molecular Formula C30H23N5O
Molecular Weight 469.5365
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:40:17 UTC 2023
Edited
by admin
on Fri Dec 15 15:40:17 UTC 2023
Record UNII
RUJ6Z9Y0DT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DACTOLISIB
INN   USAN   WHO-DD  
USAN   INN  
Official Name English
RTB101
Code English
RTB-101
Code English
NSC-751249
Code English
dactolisib [INN]
Common Name English
2-Methyl-2-(4-{3-methyl-2-oxo-8-(quinolin-3-yl)-2,3-dihydroimidazo[4,5-c]quinolin-1-yl}phenyl)propanenitrile
Systematic Name English
2-METHYL-2-(4-(3-METHYL-2-OXO-8-QUINOLIN-3-YL-2,3-DIHYDRO-1H-IMIDAZO(4,5-C)QUINOLIN-1-YL)PHENYL)PROPANENITRILE
Systematic Name English
BEZ-235
Code English
BEZ235
Code English
DACTOLISIB [USAN]
Common Name English
Dactolisib [WHO-DD]
Common Name English
NVP-BEZ-235
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C2152
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
NCI_THESAURUS C129825
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
Code System Code Type Description
MESH
C531198
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
CAS
915019-65-7
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
SMS_ID
100000170045
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
PUBCHEM
11977753
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
FDA UNII
RUJ6Z9Y0DT
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
INN
9545
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
CHEBI
71952
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
WIKIPEDIA
BEZ235
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
ChEMBL
CHEMBL1879463
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
EPA CompTox
DTXSID10238599
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
DRUG BANK
DB11651
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
USAN
AB-105
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
EVMPD
SUB183868
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
NSC
751249
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
NCI_THESAURUS
C74072
Created by admin on Fri Dec 15 15:40:17 UTC 2023 , Edited by admin on Fri Dec 15 15:40:17 UTC 2023
PRIMARY
Related Record Type Details
SERINE/THREONINE-PROTEIN KINASE MTOR
TARGET -> INHIBITOR
PHOSPHATIDYLINOSITOL 4,5-BISPHOSPHATE 3-KINASE CATALYTIC SUBUNIT ALPHA ISOFORM
TARGET -> INHIBITOR
PHOSPHATIDYLINOSITOL 4,5-BISPHOSPHATE 3-KINASE CATALYTIC SUBUNIT DELTA ISOFORM
TARGET -> INHIBITOR
Related Record Type Details
Structure of DACTOLISIB
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