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

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H20F3N3O4S
Molecular Weight 479.474
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of REZVILUTAMIDE

SMILES

CC1(C)C(=O)N(c2ccc(C#N)c(c2)C(F)(F)F)C(=S)N1c3ccc(cc3)OC[C@]([H])(CO)O

InChI

InChIKey=KRBMOYIWQCZVHA-INIZCTEOSA-N
InChI=1S/C22H20F3N3O4S/c1-21(2)19(31)27(15-4-3-13(10-26)18(9-15)22(23,24)25)20(33)28(21)14-5-7-17(8-6-14)32-12-16(30)11-29/h3-9,16,29-30H,11-12H2,1-2H3/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H20F3N3O4S
Molecular Weight 479.474
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 Sat Jun 26 09:27:40 UTC 2021
Edited
by admin
on Sat Jun 26 09:27:40 UTC 2021
Record UNII
70FJN2AW22
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
REZVILUTAMIDE
INN  
Official Name English
4-(3-(4-((S)-2,3-DIHYDROXYPROPOXY)PHENYL)-4,4-DIMETHYL-5-OXO-2-THIOXOIMIDAZOLIDIN-1-YL)-2-(TRIFLUOROMETHYL)BENZONITRILE
Systematic Name English
REZVILUTAMIDE [INN]
Common Name English
BENZONITRILE, 4-(3-(4-((2S)-2,3-DIHYDROXYPROPOXY)PHENYL)-4,4-DIMETHYL-5-OXO-2-THIOXO-1-IMIDAZOLIDINYL)-2-(TRIFLUOROMETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
70FJN2AW22
Created by admin on Sat Jun 26 09:27:40 UTC 2021 , Edited by admin on Sat Jun 26 09:27:40 UTC 2021
PRIMARY
INN
11427
Created by admin on Sat Jun 26 09:27:40 UTC 2021 , Edited by admin on Sat Jun 26 09:27:40 UTC 2021
PRIMARY
NCI_THESAURUS
C175852
Created by admin on Sat Jun 26 09:27:40 UTC 2021 , Edited by admin on Sat Jun 26 09:27:40 UTC 2021
PRIMARY
PUBCHEM
89995232
Created by admin on Sat Jun 26 09:27:40 UTC 2021 , Edited by admin on Sat Jun 26 09:27:40 UTC 2021
PRIMARY
CAS
1572045-62-5
Created by admin on Sat Jun 26 09:27:40 UTC 2021 , Edited by admin on Sat Jun 26 09:27:40 UTC 2021
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY