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Details

Stereochemistry ACHIRAL
Molecular Formula C21H16F4N4O3S
Molecular Weight 480.435
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZAMIDE, 4-(3-(4-CYANO-3-(TRIFLUOROMETHYL)PHENYL)-5,5-DIMETHYL-4-OXO-2-THIOXO-1-IMIDAZOLIDINYL)-2-FLUORO-N-(HYDROXYMETHYL)-

SMILES

CC1(C)N(C(=S)N(C1=O)C2=CC(=C(C=C2)C#N)C(F)(F)F)C3=CC=C(C(=O)NCO)C(F)=C3

InChI

InChIKey=GCQDHCAKABLTGP-UHFFFAOYSA-N
InChI=1S/C21H16F4N4O3S/c1-20(2)18(32)28(12-4-3-11(9-26)15(7-12)21(23,24)25)19(33)29(20)13-5-6-14(16(22)8-13)17(31)27-10-30/h3-8,30H,10H2,1-2H3,(H,27,31)

HIDE SMILES / InChI

Molecular Formula C21H16F4N4O3S
Molecular Weight 480.435
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 Thu Jul 06 20:10:07 UTC 2023
Edited
by admin
on Thu Jul 06 20:10:07 UTC 2023
Record UNII
KLY798P76T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZAMIDE, 4-(3-(4-CYANO-3-(TRIFLUOROMETHYL)PHENYL)-5,5-DIMETHYL-4-OXO-2-THIOXO-1-IMIDAZOLIDINYL)-2-FLUORO-N-(HYDROXYMETHYL)-
Systematic Name English
ENZALUTAMIDE METABOLITE M6
Common Name English
Code System Code Type Description
CAS
2226511-32-4
Created by admin on Thu Jul 06 20:10:07 UTC 2023 , Edited by admin on Thu Jul 06 20:10:07 UTC 2023
PRIMARY
PUBCHEM
156596418
Created by admin on Thu Jul 06 20:10:07 UTC 2023 , Edited by admin on Thu Jul 06 20:10:07 UTC 2023
PRIMARY
FDA UNII
KLY798P76T
Created by admin on Thu Jul 06 20:10:07 UTC 2023 , Edited by admin on Thu Jul 06 20:10:07 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
Trace amount of M6 was observed in urine (≤ 0.42% of the dose) and plasma (≤ 2% of the radioactivity in the 6- and 24-hour postdose plasma samples and not detected at any other time point).
MINOR
PLASMA; URINE