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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H25N5
Molecular Weight 287.4032
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KB-0742

SMILES

CCC(CC)C1=NC2=CC=NN2C(N[C@H]3CC[C@H](N)C3)=C1

InChI

InChIKey=VYKCLMALANGCDF-STQMWFEESA-N
InChI=1S/C16H25N5/c1-3-11(4-2)14-10-16(19-13-6-5-12(17)9-13)21-15(20-14)7-8-18-21/h7-8,10-13,19H,3-6,9,17H2,1-2H3/t12-,13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H25N5
Molecular Weight 287.4032
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:59:35 GMT 2023
Edited
by admin
on Sat Dec 16 17:59:35 GMT 2023
Record UNII
F7J6KSY5I8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
KB-0742
Code English
(1S,3S)-N<sup>1</sup>-[5-(1-Ethylpropyl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3-cyclopentanediamine
Systematic Name English
(1S,3S)-3-Amino-1-[5-(1-ethylpropyl)-1,4,7a-triazainden-7-ylamino]cyclopentane
Systematic Name English
1,3-Cyclopentanediamine, N<sup>1</sup>-[5-(1-ethylpropyl)pyrazolo[1,5-a]pyrimidin-7-yl]-, (1S,3S)-
Systematic Name English
KB0742
Code English
Code System Code Type Description
PUBCHEM
146502834
Created by admin on Sat Dec 16 17:59:37 GMT 2023 , Edited by admin on Sat Dec 16 17:59:37 GMT 2023
PRIMARY
CAS
2416873-83-9
Created by admin on Sat Dec 16 17:59:37 GMT 2023 , Edited by admin on Sat Dec 16 17:59:37 GMT 2023
PRIMARY
FDA UNII
F7J6KSY5I8
Created by admin on Sat Dec 16 17:59:37 GMT 2023 , Edited by admin on Sat Dec 16 17:59:37 GMT 2023
PRIMARY
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