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Details

Stereochemistry ACHIRAL
Molecular Formula C19H27ClN4O3
Molecular Weight 394.896
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Carbamic acid, N-[[1-[2-chloro-6-(hydroxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]methyl]-, 1,1-dimethylethyl ester

SMILES

CC(C)(C)OC(=O)NCC1(CCCCC1)N2C(CO)=CC3=C2N=C(Cl)N=C3

InChI

InChIKey=VDJAKLRHRZFMON-UHFFFAOYSA-N
InChI=1S/C19H27ClN4O3/c1-18(2,3)27-17(26)22-12-19(7-5-4-6-8-19)24-14(11-25)9-13-10-21-16(20)23-15(13)24/h9-10,25H,4-8,11-12H2,1-3H3,(H,22,26)

HIDE SMILES / InChI

Molecular Formula C19H27ClN4O3
Molecular Weight 394.896
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 19:53:27 GMT 2025
Edited
by admin
on Wed Apr 02 19:53:27 GMT 2025
Record UNII
DL6GQH67JN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Carbamic acid, N-[[1-[2-chloro-6-(hydroxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]methyl]-, 1,1-dimethylethyl ester
Preferred Name English
Code System Code Type Description
FDA UNII
DL6GQH67JN
Created by admin on Wed Apr 02 19:53:27 GMT 2025 , Edited by admin on Wed Apr 02 19:53:27 GMT 2025
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PUBCHEM
156227853
Created by admin on Wed Apr 02 19:53:27 GMT 2025 , Edited by admin on Wed Apr 02 19:53:27 GMT 2025
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CAS
2884520-26-5
Created by admin on Wed Apr 02 19:53:27 GMT 2025 , Edited by admin on Wed Apr 02 19:53:27 GMT 2025
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