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Details

Stereochemistry ACHIRAL
Molecular Formula C43H36F6N4O2
Molecular Weight 754.762
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BMS-212122

SMILES

CC1=NC2=C(NC(=O)C3=CC=CC=C3C4=CC=C(C=C4)C(F)(F)F)C(C)=CC=C2N1CCCCC5(C(=O)NCC(F)(F)F)C6=C(C=CC=C6)C7=C5C=CC=C7

InChI

InChIKey=PCOWNQCLFYEXLR-UHFFFAOYSA-N
InChI=1S/C43H36F6N4O2/c1-26-17-22-36-38(37(26)52-39(54)33-14-4-3-11-30(33)28-18-20-29(21-19-28)43(47,48)49)51-27(2)53(36)24-10-9-23-41(40(55)50-25-42(44,45)46)34-15-7-5-12-31(34)32-13-6-8-16-35(32)41/h3-8,11-22H,9-10,23-25H2,1-2H3,(H,50,55)(H,52,54)

HIDE SMILES / InChI

Molecular Formula C43H36F6N4O2
Molecular Weight 754.762
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 09:27:35 GMT 2023
Edited
by admin
on Sat Dec 16 09:27:35 GMT 2023
Record UNII
0Z473OO6GB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BMS-212122
Common Name English
9H-FLUORENE-9-CARBOXAMIDE, 9-(4-(2,5-DIMETHYL-4-(((4'-(TRIFLUOROMETHYL)(1,1'-BIPHENYL)-2-YL)CARBONYL)AMINO)-1H-BENZIMIDAZOL-1-YL)BUTYL)-N-(2,2,2-TRIFLUOROETHYL)-
Systematic Name English
Code System Code Type Description
CAS
194213-64-4
Created by admin on Sat Dec 16 09:27:35 GMT 2023 , Edited by admin on Sat Dec 16 09:27:35 GMT 2023
PRIMARY
FDA UNII
0Z473OO6GB
Created by admin on Sat Dec 16 09:27:35 GMT 2023 , Edited by admin on Sat Dec 16 09:27:35 GMT 2023
PRIMARY
PUBCHEM
9853566
Created by admin on Sat Dec 16 09:27:35 GMT 2023 , Edited by admin on Sat Dec 16 09:27:35 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY