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Details

Stereochemistry RACEMIC
Molecular Formula C22H23N3O3S
Molecular Weight 409.5032
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0
Stereo Comments Assumed racemic

SHOW SMILES / InChI
Structure of CJ-13610 S-OXIDE

SMILES

Cc1nccn1-c2ccc(cc2)S(=O)c3cccc(c3)C4(CCOCC4)C(=N)O

InChI

InChIKey=POAZJTPZGILARH-UHFFFAOYSA-N
InChI=1S/C22H23N3O3S/c1-16-24-11-12-25(16)18-5-7-19(8-6-18)29(27)20-4-2-3-17(15-20)22(21(23)26)9-13-28-14-10-22/h2-8,11-12,15H,9-10,13-14H2,1H3,(H2,23,26)

HIDE SMILES / InChI

Molecular Formula C22H23N3O3S
Molecular Weight 409.5032
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 Fri Jun 25 20:47:22 UTC 2021
Edited
by admin
on Fri Jun 25 20:47:22 UTC 2021
Record UNII
QGL2486XU2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CJ-13610 S-OXIDE
Common Name English
2H-PYRAN-4-CARBOXAMIDE, TETRAHYDRO-4-(3-((4-(2-METHYL-1H-IMIDAZOL-1-YL)PHENYL)SULFINYL)PHENYL)-
Systematic Name English
CP-680179
Common Name English
CJ-13610 METABOLITE M2
Common Name English
Code System Code Type Description
PUBCHEM
155884422
Created by admin on Fri Jun 25 20:47:22 UTC 2021 , Edited by admin on Fri Jun 25 20:47:22 UTC 2021
PRIMARY
FDA UNII
QGL2486XU2
Created by admin on Fri Jun 25 20:47:22 UTC 2021 , Edited by admin on Fri Jun 25 20:47:22 UTC 2021
PRIMARY
CAS
862686-91-7
Created by admin on Fri Jun 25 20:47:22 UTC 2021 , Edited by admin on Fri Jun 25 20:47:22 UTC 2021
PRIMARY
Related Record Type Details
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