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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H21F2N3O
Molecular Weight 357.397
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TC-6987

SMILES

FC1=CC(=CC(F)=C1)C(=O)N[C@@H]2C3CCN(CC3)[C@H]2CC4=CN=CC=C4

InChI

InChIKey=UAKZGMMGIMKFMV-RBUKOAKNSA-N
InChI=1S/C20H21F2N3O/c21-16-9-15(10-17(22)11-16)20(26)24-19-14-3-6-25(7-4-14)18(19)8-13-2-1-5-23-12-13/h1-2,5,9-12,14,18-19H,3-4,6-8H2,(H,24,26)/t18-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H21F2N3O
Molecular Weight 357.397
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 02:10:02 GMT 2023
Edited
by admin
on Sat Dec 16 02:10:02 GMT 2023
Record UNII
Q2U4R164OG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TC-6987
Code English
(2S,3R)-N-(2-(3-PYRIDINYLMETHYL)-1-AZABICYCLO(2.2.2)OCT-3-YL)-3,5-DIFLUOROBENZAMIDE
Systematic Name English
BENZAMIDE, 3,5-DIFLUORO-N-((2S,3R)-2-(3-PYRIDINYLMETHYL)-1-AZABICYCLO(2.2.2)OCT-3-YL)-
Systematic Name English
Code System Code Type Description
FDA UNII
Q2U4R164OG
Created by admin on Sat Dec 16 02:10:02 GMT 2023 , Edited by admin on Sat Dec 16 02:10:02 GMT 2023
PRIMARY
DRUG BANK
DB14854
Created by admin on Sat Dec 16 02:10:02 GMT 2023 , Edited by admin on Sat Dec 16 02:10:02 GMT 2023
PRIMARY
PUBCHEM
44511587
Created by admin on Sat Dec 16 02:10:02 GMT 2023 , Edited by admin on Sat Dec 16 02:10:02 GMT 2023
PRIMARY
ChEMBL
CHEMBL3545410
Created by admin on Sat Dec 16 02:10:02 GMT 2023 , Edited by admin on Sat Dec 16 02:10:02 GMT 2023
PRIMARY
CAS
1196701-27-5
Created by admin on Sat Dec 16 02:10:02 GMT 2023 , Edited by admin on Sat Dec 16 02:10:02 GMT 2023
PRIMARY
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