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Details

Stereochemistry ACHIRAL
Molecular Formula C20H21N9O4
Molecular Weight 454.4571
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-nitroso-deucravacitinib

SMILES

[2H]C([2H])([2H])NC(=O)C1=C(C=C(NC(=O)C2CC2)N=N1)N(N=O)C3=CC=CC(C4=NN(C)C=N4)=C3OC

InChI

InChIKey=OHXCAWRVRXPSPS-FIBGUPNXSA-N
InChI=1S/C20H21N9O4/c1-21-20(31)16-14(9-15(24-25-16)23-19(30)11-7-8-11)29(27-32)13-6-4-5-12(17(13)33-3)18-22-10-28(2)26-18/h4-6,9-11H,7-8H2,1-3H3,(H,21,31)(H,23,24,30)/i1D3

HIDE SMILES / InChI

Molecular Formula C20H21N9O4
Molecular Weight 454.4571
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 Wed Apr 02 17:56:06 GMT 2025
Edited
by admin
on Wed Apr 02 17:56:06 GMT 2025
Record UNII
R76CVX7YKX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-nitroso-deucravacitinib
Preferred Name English
Code System Code Type Description
FDA UNII
R76CVX7YKX
Created by admin on Wed Apr 02 17:56:06 GMT 2025 , Edited by admin on Wed Apr 02 17:56:06 GMT 2025
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