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Details

Stereochemistry ACHIRAL
Molecular Formula C18H20FN3
Molecular Weight 299.3624
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NBI-2

SMILES

CN([14CH3])CCC1=C(CC2=CC=CN=N2)C3=CC=C(F)C=C3C1

InChI

InChIKey=YVEWHDHDFNFTCD-NJFSPNSNSA-N
InChI=1S/C18H20FN3/c1-22(2)9-7-13-10-14-11-15(19)5-6-17(14)18(13)12-16-4-3-8-20-21-16/h3-6,8,11H,7,9-10,12H2,1-2H3/i1+2

HIDE SMILES / InChI

Molecular Formula C18H20FN3
Molecular Weight 299.3624
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 Sat Dec 16 16:10:33 GMT 2023
Edited
by admin
on Sat Dec 16 16:10:33 GMT 2023
Record UNII
Z7XU1T6K9Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NBI-2
Code English
1H-INDENE-2-ETHANAMINE, 6-FLUORO-N-METHYL-N-(METHYL-14C)-3-(3-PYRIDAZINYLMETHYL)-
Systematic Name English
NBI-2 C-14
Common Name English
Code System Code Type Description
PUBCHEM
25265811
Created by admin on Sat Dec 16 16:10:33 GMT 2023 , Edited by admin on Sat Dec 16 16:10:33 GMT 2023
PRIMARY
FDA UNII
Z7XU1T6K9Q
Created by admin on Sat Dec 16 16:10:33 GMT 2023 , Edited by admin on Sat Dec 16 16:10:33 GMT 2023
PRIMARY
CAS
1190929-44-2
Created by admin on Sat Dec 16 16:10:33 GMT 2023 , Edited by admin on Sat Dec 16 16:10:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID701031285
Created by admin on Sat Dec 16 16:10:33 GMT 2023 , Edited by admin on Sat Dec 16 16:10:33 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
NON-LABELED -> LABELED
Related Record Type Details
ACTIVE MOIETY