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Details

Stereochemistry ACHIRAL
Molecular Formula C27H26F3N3O3
Molecular Weight 497.5088
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CP-467688 FREE BASE

SMILES

COC(=O)NCCN1CCC2=C(C1)C=CC(NC(=O)C3=CC=CC=C3C4=CC=C(C=C4)C(F)(F)F)=C2

InChI

InChIKey=FJULIZHZIHXKSK-UHFFFAOYSA-N
InChI=1S/C27H26F3N3O3/c1-36-26(35)31-13-15-33-14-12-19-16-22(11-8-20(19)17-33)32-25(34)24-5-3-2-4-23(24)18-6-9-21(10-7-18)27(28,29)30/h2-11,16H,12-15,17H2,1H3,(H,31,35)(H,32,34)

HIDE SMILES / InChI

Molecular Formula C27H26F3N3O3
Molecular Weight 497.5088
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 08:26:39 GMT 2023
Edited
by admin
on Sat Dec 16 08:26:39 GMT 2023
Record UNII
Q25Z3ZO7RK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CP-467688 FREE BASE
Common Name English
CARBAMIC ACID, (2-(3,4-DIHYDRO-6-(((4'-(TRIFLUOROMETHYL)(1,1'-BIPHENYL)-2-YL)CARBONYL)AMINO)-2(1H)-ISOQUINOLINYL)ETHYL)-, METHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
Q25Z3ZO7RK
Created by admin on Sat Dec 16 08:26:40 GMT 2023 , Edited by admin on Sat Dec 16 08:26:40 GMT 2023
PRIMARY
PUBCHEM
10207031
Created by admin on Sat Dec 16 08:26:40 GMT 2023 , Edited by admin on Sat Dec 16 08:26:40 GMT 2023
PRIMARY
CAS
208590-81-2
Created by admin on Sat Dec 16 08:26:40 GMT 2023 , Edited by admin on Sat Dec 16 08:26:40 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY