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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H23N3
Molecular Weight 293.406
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NBI-3 (NON-LABELED)

SMILES

C[C@H](C1=C(CCN(C)C)CC2=CC=CC=C12)C3=NC=CN=C3

InChI

InChIKey=AYEYSXMZCARQKR-AWEZNQCLSA-N
InChI=1S/C19H23N3/c1-14(18-13-20-9-10-21-18)19-16(8-11-22(2)3)12-15-6-4-5-7-17(15)19/h4-7,9-10,13-14H,8,11-12H2,1-3H3/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H23N3
Molecular Weight 293.406
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 16:46:39 UTC 2023
Edited
by admin
on Sat Dec 16 16:46:39 UTC 2023
Record UNII
WQ8PCH72SD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NBI-3 (NON-LABELED)
Code English
N,N-DIMETHYL-3-((1R)-1-(2-PYRAZINYL)ETHYL)-1H-INDENE-2-ETHANAMINE
Systematic Name English
1H-INDENE-2-ETHANAMINE, N,N-DIMETHYL-3-((1R)-1-(2-PYRAZINYL)ETHYL)-
Systematic Name English
Code System Code Type Description
CAS
867036-04-2
Created by admin on Sat Dec 16 16:46:39 UTC 2023 , Edited by admin on Sat Dec 16 16:46:39 UTC 2023
PRIMARY
EPA CompTox
DTXSID801031288
Created by admin on Sat Dec 16 16:46:39 UTC 2023 , Edited by admin on Sat Dec 16 16:46:39 UTC 2023
PRIMARY
PUBCHEM
44247806
Created by admin on Sat Dec 16 16:46:39 UTC 2023 , Edited by admin on Sat Dec 16 16:46:39 UTC 2023
PRIMARY
FDA UNII
WQ8PCH72SD
Created by admin on Sat Dec 16 16:46:39 UTC 2023 , Edited by admin on Sat Dec 16 16:46:39 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
LABELED -> NON-LABELED
Related Record Type Details
ACTIVE MOIETY