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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H13N3S
Molecular Weight 219.306
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PNU-142774E

SMILES

CN[C@H]1CN2C(=S)NC3=C2C(C1)=CC=C3

InChI

InChIKey=QJOMEJDBLGGZNA-MRVPVSSYSA-N
InChI=1S/C11H13N3S/c1-12-8-5-7-3-2-4-9-10(7)14(6-8)11(15)13-9/h2-4,8,12H,5-6H2,1H3,(H,13,15)/t8-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H13N3S
Molecular Weight 219.306
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 20:17:59 GMT 2023
Edited
by admin
on Sat Dec 16 20:17:59 GMT 2023
Record UNII
KJN6KTF7D8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PNU-142774E
Code English
4H-Imidazo[4,5,1-ij]quinoline-2(1H)-thione, 5,6-dihydro-5-(methylamino)-, (5R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
9815850
Created by admin on Sat Dec 16 20:17:59 GMT 2023 , Edited by admin on Sat Dec 16 20:17:59 GMT 2023
PRIMARY
CAS
282522-93-4
Created by admin on Sat Dec 16 20:17:59 GMT 2023 , Edited by admin on Sat Dec 16 20:17:59 GMT 2023
PRIMARY
FDA UNII
KJN6KTF7D8
Created by admin on Sat Dec 16 20:17:59 GMT 2023 , Edited by admin on Sat Dec 16 20:17:59 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY