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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H28N6O2
Molecular Weight 396.486
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DINACICLIB

SMILES

CCC1=C2N=C(C=C(NCC3=C[N+]([O-])=CC=C3)N2N=C1)N4CCCC[C@H]4CCO

InChI

InChIKey=PIMQWRZWLQKKBJ-SFHVURJKSA-N
InChI=1S/C21H28N6O2/c1-2-17-14-23-27-19(22-13-16-6-5-9-25(29)15-16)12-20(24-21(17)27)26-10-4-3-7-18(26)8-11-28/h5-6,9,12,14-15,18,22,28H,2-4,7-8,10-11,13H2,1H3/t18-/m0/s1

HIDE SMILES / InChI
Molecular Formula C21H28N6O2
Molecular Weight 396.486
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:30:41 UTC 2023
Edited
by admin
on Fri Dec 15 17:30:41 UTC 2023
Record UNII
4V8ECV0NBQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DINACICLIB
INN   USAN   WHO-DD  
USAN   INN  
Official Name English
Dinaciclib [WHO-DD]
Common Name English
SCH727965
Code English
3-[[[3-Ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl]amino]methyl]pyridine 1-oxide
Systematic Name English
DINACICLIB [USAN]
Common Name English
SCH-727965
Code English
dinaciclib [INN]
Common Name English
2-PIPERIDINEETHANOL, 1-(3-ETHYL-7-(((1-OXIDO-3-PYRIDINYL)METHYL)AMINO)PYRAZOLO(1,5- A)PYRIMIDIN-5-YL)-, (2S)-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C2185
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
FDA ORPHAN DRUG 347211
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
NCI_THESAURUS C129825
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
EU-Orphan Drug EU/3/11/901
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
Code System Code Type Description
MESH
C553669
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
NCI_THESAURUS
C78854
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
EPA CompTox
DTXSID90999131
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
WIKIPEDIA
Dinaciclib
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
SMS_ID
100000134800
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
USAN
UU-88
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
ChEMBL
CHEMBL2103840
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
CAS
779353-01-4
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
DRUG BANK
DB12021
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
FDA UNII
4V8ECV0NBQ
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
EVMPD
SUB64819
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
PUBCHEM
46926350
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
INN
9157
Created by admin on Fri Dec 15 17:30:42 UTC 2023 , Edited by admin on Fri Dec 15 17:30:42 UTC 2023
PRIMARY
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Structure of DINACICLIB
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