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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H21F6N5O2
Molecular Weight 525.4463
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BMS-963272

SMILES

CC1=CC=C(C=C1)C2=C(C3=NN=NN3)C(=O)N[C@@](C2)(C4=CC=C(OCCCC(F)(F)F)C=C4)C(F)(F)F

InChI

InChIKey=AEMPUAWUDAMJBV-QFIPXVFZSA-N
InChI=1S/C24H21F6N5O2/c1-14-3-5-15(6-4-14)18-13-22(24(28,29)30,31-21(36)19(18)20-32-34-35-33-20)16-7-9-17(10-8-16)37-12-2-11-23(25,26)27/h3-10H,2,11-13H2,1H3,(H,31,36)(H,32,33,34,35)/t22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H21F6N5O2
Molecular Weight 525.4463
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 09:44:47 GMT 2023
Edited
by admin
on Sat Dec 16 09:44:47 GMT 2023
Record UNII
0V8WFB28CB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BMS-963272
Code English
2(1H)-Pyridinone, 5,6-dihydro-4-(4-methylphenyl)-3-(2H-tetrazol-5-yl)-6-[4-(4,4,4-trifluorobutoxy)phenyl]-6-(trifluoromethyl)-, (6S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
71582672
Created by admin on Sat Dec 16 09:44:47 GMT 2023 , Edited by admin on Sat Dec 16 09:44:47 GMT 2023
PRIMARY
FDA UNII
0V8WFB28CB
Created by admin on Sat Dec 16 09:44:47 GMT 2023 , Edited by admin on Sat Dec 16 09:44:47 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
IC50
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ACTIVE MOIETY