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Details

Stereochemistry ACHIRAL
Molecular Formula C31H34N6O5
Molecular Weight 570.6389
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of R-337647

SMILES

O=C(CN1N=C(C2CCCCC2)C3=CC=CC=C3N(CC(=O)C4CCCC4)C1=O)NC5=CC=CC(=C5)C6=NC(=O)ON6

InChI

InChIKey=DGKMBNVRIZTNTK-UHFFFAOYSA-N
InChI=1S/C31H34N6O5/c38-26(20-9-4-5-10-20)18-36-25-16-7-6-15-24(25)28(21-11-2-1-3-12-21)34-37(31(36)41)19-27(39)32-23-14-8-13-22(17-23)29-33-30(40)42-35-29/h6-8,13-17,20-21H,1-5,9-12,18-19H2,(H,32,39)(H,33,35,40)

HIDE SMILES / InChI

Molecular Formula C31H34N6O5
Molecular Weight 570.6389
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 20:52:42 GMT 2025
Edited
by admin
on Wed Apr 02 20:52:42 GMT 2025
Record UNII
594TAX37E6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
R-337647
Code English
R337647
Preferred Name English
5-Cyclohexyl-1-(2-cyclopentyl-2-oxoethyl)-N-[3-(2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl)phenyl]-1,2-dihydro-2-oxo-3H-1,3,4-benzotriazepine-3-acetamide
Systematic Name English
2-[5-Cyclohexyl-1-(2-cyclopentyl-2-oxo-ethyl)-2-oxo-1,2-dihydro3H-1,3,4-benzotriazepin-3-yl]-N-[3-(5-oxo-2,5-dihydro-[1,2,4]oxadiazol-3-yl)-phenyl]acetamide
Systematic Name English
3H-1,3,4-Benzotriazepine-3-acetamide, 5-cyclohexyl-1-(2-cyclopentyl-2-oxoethyl)-N-[3-(2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl)phenyl]-1,2-dihydro-2-oxo-
Systematic Name English
Code System Code Type Description
FDA UNII
594TAX37E6
Created by admin on Wed Apr 02 20:52:42 GMT 2025 , Edited by admin on Wed Apr 02 20:52:42 GMT 2025
PRIMARY
PUBCHEM
135423404
Created by admin on Wed Apr 02 20:52:42 GMT 2025 , Edited by admin on Wed Apr 02 20:52:42 GMT 2025
PRIMARY
CAS
528884-77-7
Created by admin on Wed Apr 02 20:52:42 GMT 2025 , Edited by admin on Wed Apr 02 20:52:42 GMT 2025
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
SALT/SOLVATE -> PARENT
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ACTIVE MOIETY