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Details

Stereochemistry ACHIRAL
Molecular Formula C17H15N3OS
Molecular Weight 308.386
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of PBB-3 C-11

SMILES

[11CH3]NC1=CC=C(\C=C\C=C\C2=NC3=C(S2)C=C(O)C=C3)C=N1

InChI

InChIKey=LBCRWMJTAFCLCL-DXDJJUBJSA-N
InChI=1S/C17H15N3OS/c1-18-16-9-6-12(11-19-16)4-2-3-5-17-20-14-8-7-13(21)10-15(14)22-17/h2-11,21H,1H3,(H,18,19)/b4-2+,5-3+/i1-1

HIDE SMILES / InChI

Molecular Formula C17H15N3OS
Molecular Weight 308.386
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:34:20 GMT 2023
Edited
by admin
on Fri Dec 15 17:34:20 GMT 2023
Record UNII
WX8YA1PJTB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PBB-3 C-11
Common Name English
6-BENZOTHIAZOLOL, 2-((1E,3E)-4-(6-(METHYL-11C-AMINO)-3-PYRIDINYL)-1,3-BUTADIEN-1-YL)-
Common Name English
PBB3 C-11
Common Name English
(11C)PBB3
Common Name English
Code System Code Type Description
FDA UNII
WX8YA1PJTB
Created by admin on Fri Dec 15 17:34:20 GMT 2023 , Edited by admin on Fri Dec 15 17:34:20 GMT 2023
PRIMARY
CAS
1565797-40-1
Created by admin on Fri Dec 15 17:34:20 GMT 2023 , Edited by admin on Fri Dec 15 17:34:20 GMT 2023
PRIMARY
PUBCHEM
91668187
Created by admin on Fri Dec 15 17:34:20 GMT 2023 , Edited by admin on Fri Dec 15 17:34:20 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY