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Details

Stereochemistry ACHIRAL
Molecular Formula C14H15F2N3O2
Molecular Weight 295.2846
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Oditrasertib

SMILES

CC(C)(C(F)F)C(=O)N1CCOC2=C(C=NC=C2C1)C#N

InChI

InChIKey=CSCLQCHKUAMZOY-UHFFFAOYSA-N
InChI=1S/C14H15F2N3O2/c1-14(2,12(15)16)13(20)19-3-4-21-11-9(5-17)6-18-7-10(11)8-19/h6-7,12H,3-4,8H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C14H15F2N3O2
Molecular Weight 295.2846
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 Sat Dec 16 17:11:14 UTC 2023
Edited
by admin
on Sat Dec 16 17:11:14 UTC 2023
Record UNII
I1YQT8HC89
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Oditrasertib
INN  
Official Name English
PYRIDO(3,4-F)-1,4-OXAZEPINE-9-CARBONITRILE, 4-(3,3-DIFLUORO-2,2-DIMETHYL-1-OXOPROPYL)-2,3,4,5-TETRAHYDRO-
Systematic Name English
4-(3,3-difluoro-2,2-dimethylpropanoyl)-2,3,4,5- tetrahydropyrido[3,4-f][1,4]oxazepine-9-carbonitrile
Systematic Name English
oditrasertib [INN]
Common Name English
4-(3,3-difluoro-2,2-dimethylpropanoyl)-2,3,4,5- tetrahydropyrido[3,4-f][1,4]oxazepine-9-carbonitrile
Systematic Name English
4-(3,3-DIFLUORO-2,2-DIMETHYLPROPANOYL)-3,5-DIHYDRO-2H-PYRIDO(3,4-F)(1,4)OXAZEPINE-9-CARBONITRILE
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C199081
Created by admin on Sat Dec 16 17:11:14 UTC 2023 , Edited by admin on Sat Dec 16 17:11:14 UTC 2023
PRIMARY
FDA UNII
I1YQT8HC89
Created by admin on Sat Dec 16 17:11:14 UTC 2023 , Edited by admin on Sat Dec 16 17:11:14 UTC 2023
PRIMARY
PUBCHEM
135382587
Created by admin on Sat Dec 16 17:11:14 UTC 2023 , Edited by admin on Sat Dec 16 17:11:14 UTC 2023
PRIMARY
CAS
2252271-93-3
Created by admin on Sat Dec 16 17:11:14 UTC 2023 , Edited by admin on Sat Dec 16 17:11:14 UTC 2023
PRIMARY
INN
12578
Created by admin on Sat Dec 16 17:11:14 UTC 2023 , Edited by admin on Sat Dec 16 17:11:14 UTC 2023
PRIMARY
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