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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H22N4O3
Molecular Weight 402.4458
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PR-101442

SMILES

CC(C)OC1=C(C=C(C=C1)C2=NC(=NO2)C3=C4CC[C@H](NC(C)=O)C4=CC=C3)C#N

InChI

InChIKey=FVWMDPLFGXHGCN-FQEVSTJZSA-N
InChI=1S/C23H22N4O3/c1-13(2)29-21-10-7-15(11-16(21)12-24)23-26-22(27-30-23)19-6-4-5-18-17(19)8-9-20(18)25-14(3)28/h4-7,10-11,13,20H,8-9H2,1-3H3,(H,25,28)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H22N4O3
Molecular Weight 402.4458
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:06:34 UTC 2023
Edited
by admin
on Sat Dec 16 16:06:34 UTC 2023
Record UNII
Q2Q3WJK6VL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PR-101442
Code English
ACETAMIDE, N-((1S)-4-(5-(3-CYANO-4-(1-METHYLETHOXY)PHENYL)-1,2,4-OXADIAZOL-3-YL)-2,3-DIHYDRO-1H-INDEN-1-YL)-
Systematic Name English
N-((1S)-4-(5-(3-CYANO-4-(1-METHYLETHOXY)PHENYL)-1,2,4-OXADIAZOL-3-YL)-2,3-DIHYDRO-1H-INDEN-1-YL)ACETAMIDE
Systematic Name English
PR101442
Code English
Code System Code Type Description
CAS
1306761-08-9
Created by admin on Sat Dec 16 16:06:34 UTC 2023 , Edited by admin on Sat Dec 16 16:06:34 UTC 2023
PRIMARY
FDA UNII
Q2Q3WJK6VL
Created by admin on Sat Dec 16 16:06:34 UTC 2023 , Edited by admin on Sat Dec 16 16:06:34 UTC 2023
PRIMARY
PUBCHEM
52939166
Created by admin on Sat Dec 16 16:06:34 UTC 2023 , Edited by admin on Sat Dec 16 16:06:34 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
SELECTIVE
TARGET -> AGONIST
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PARENT -> METABOLITE ACTIVE
PLASMA