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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H12ClN3O3
Molecular Weight 317.727
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Vicadrostat

SMILES

C[C@]1(CO)CC2=C(N(C=N2)C3=CC=C(C#N)C(Cl)=C3)C(=O)O1

InChI

InChIKey=MCVIVPZYYMNCAW-OAHLLOKOSA-N
InChI=1S/C15H12ClN3O3/c1-15(7-20)5-12-13(14(21)22-15)19(8-18-12)10-3-2-9(6-17)11(16)4-10/h2-4,8,20H,5,7H2,1H3/t15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H12ClN3O3
Molecular Weight 317.727
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 Tue Apr 01 16:26:28 GMT 2025
Edited
by admin
on Tue Apr 01 16:26:28 GMT 2025
Record UNII
AF4VW4GA3H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
vicadrostat [INN]
Preferred Name English
Vicadrostat
INN  
Official Name English
2-Chloro-4-[(6R)-6,7-dihydro-6-(hydroxymethyl)-6-methyl-4-oxopyrano[3,4-d]imidazol-3(4H)-yl]benzonitrile
Systematic Name English
BENZONITRILE, 2-CHLORO-4-((6R)-6,7-DIHYDRO-6-(HYDROXYMETHYL)-6-METHYL-4-OXOPYRANO(3,4-D)IMIDAZOL-3(4H)-YL)-
Systematic Name English
2-CHLORO-4-((6R)-6-(HYDROXYMETHYL)-6-METHYL-4-OXO-6,7-DIHYDROPYRANO(3,4-D)IMIDAZOL-3(4H)-YL)BENZONITRILE
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C207013
Created by admin on Tue Apr 01 16:26:28 GMT 2025 , Edited by admin on Tue Apr 01 16:26:28 GMT 2025
PRIMARY
FDA UNII
AF4VW4GA3H
Created by admin on Tue Apr 01 16:26:28 GMT 2025 , Edited by admin on Tue Apr 01 16:26:28 GMT 2025
PRIMARY
SMS_ID
300000027051
Created by admin on Tue Apr 01 16:26:28 GMT 2025 , Edited by admin on Tue Apr 01 16:26:28 GMT 2025
PRIMARY
INN
12899
Created by admin on Tue Apr 01 16:26:28 GMT 2025 , Edited by admin on Tue Apr 01 16:26:28 GMT 2025
PRIMARY
CAS
1868065-21-7
Created by admin on Tue Apr 01 16:26:28 GMT 2025 , Edited by admin on Tue Apr 01 16:26:28 GMT 2025
PRIMARY
PUBCHEM
118676295
Created by admin on Tue Apr 01 16:26:28 GMT 2025 , Edited by admin on Tue Apr 01 16:26:28 GMT 2025
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY