U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C26H17F2N5O3
Molecular Weight 485.4417
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of A-373857

SMILES

CN1C=NC=C1C(OCC2=C(N=C(C=C2)C#N)C3=CC=C4OC(F)(F)OC4=C3)C5=CC=C(C=C5)C#N

InChI

InChIKey=ZIBOWPSGINTRQG-UHFFFAOYSA-N
InChI=1S/C26H17F2N5O3/c1-33-15-31-13-21(33)25(17-4-2-16(11-29)3-5-17)34-14-19-6-8-20(12-30)32-24(19)18-7-9-22-23(10-18)36-26(27,28)35-22/h2-10,13,15,25H,14H2,1H3

HIDE SMILES / InChI

Molecular Formula C26H17F2N5O3
Molecular Weight 485.4417
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:34:43 GMT 2023
Edited
by admin
on Sat Dec 16 08:34:43 GMT 2023
Record UNII
85E6V30U4T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
A-373857
Common Name English
2-PYRIDINECARBONITRILE, 5-(((4-CYANOPHENYL)(1-METHYL-1H-IMIDAZOL-5-YL)METHOXY)METHYL)-6-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL)-
Systematic Name English
5-(((4-CYANOPHENYL)(1-METHYL-1H-IMIDAZOL-5-YL)METHOXY)METHYL)-6-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL)PYRIDINE-2-CARBONITRILE
Systematic Name English
Code System Code Type Description
FDA UNII
85E6V30U4T
Created by admin on Sat Dec 16 08:34:43 GMT 2023 , Edited by admin on Sat Dec 16 08:34:43 GMT 2023
PRIMARY
PUBCHEM
10206356
Created by admin on Sat Dec 16 08:34:43 GMT 2023 , Edited by admin on Sat Dec 16 08:34:43 GMT 2023
PRIMARY
CAS
450839-23-3
Created by admin on Sat Dec 16 08:34:43 GMT 2023 , Edited by admin on Sat Dec 16 08:34:43 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY