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Details

Stereochemistry ACHIRAL
Molecular Formula C23H16F3N5OS
Molecular Weight 467.466
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 12-(1H-BENZIMIDAZOL-2-YLTHIO)-1-METHYL-2-(2,2,2-TRIFLUOROETHOXY)PYRIDO(1',2':3,4)IMIDAZO(1,2-A)BENZIMIDAZOLE

SMILES

CC1=C(OCC(F)(F)F)C=CN2C3=NC4=CC=CC=C4N3C(SC5=NC6=CC=CC=C6N5)=C12

InChI

InChIKey=BJRFQGDDNNBKOB-UHFFFAOYSA-N
InChI=1S/C23H16F3N5OS/c1-13-18(32-12-23(24,25)26)10-11-30-19(13)20(31-17-9-5-4-8-16(17)29-22(30)31)33-21-27-14-6-2-3-7-15(14)28-21/h2-11H,12H2,1H3,(H,27,28)

HIDE SMILES / InChI

Molecular Formula C23H16F3N5OS
Molecular Weight 467.466
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 19:01:30 GMT 2023
Edited
by admin
on Sat Dec 16 19:01:30 GMT 2023
Record UNII
MJ2A99A26H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
12-(1H-BENZIMIDAZOL-2-YLTHIO)-1-METHYL-2-(2,2,2-TRIFLUOROETHOXY)PYRIDO(1',2':3,4)IMIDAZO(1,2-A)BENZIMIDAZOLE
Systematic Name English
PYRIDO(1',2':3,4)IMIDAZO(1,2-A)BENZIMIDAZOLE, 12-(1H-BENZIMIDAZOL-2-YLTHIO)-1-METHYL-2-(2,2,2-TRIFLUOROETHOXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
58129422
Created by admin on Sat Dec 16 19:01:30 GMT 2023 , Edited by admin on Sat Dec 16 19:01:30 GMT 2023
PRIMARY
FDA UNII
MJ2A99A26H
Created by admin on Sat Dec 16 19:01:30 GMT 2023 , Edited by admin on Sat Dec 16 19:01:30 GMT 2023
PRIMARY
CAS
1346598-28-4
Created by admin on Sat Dec 16 19:01:30 GMT 2023 , Edited by admin on Sat Dec 16 19:01:30 GMT 2023
PRIMARY