2-((2-(5-(8-(4-CARBAMOYL-3-FLUORO-PHENYL)-5-OXO-7-THIOXO-6,8-DIAZASPIRO(3.4)OCTAN-6-YL)-3-(TRIFLUOROMETHYL)-2-PYRIDYL)-4,5-DIHYDROTHIAZOLE-4-CARBONYL)AMINO)ACETIC ACID

Details

Stereochemistry	RACEMIC
Molecular Formula	C25H20F4N6O5S2
Molecular Weight	624.587
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-((2-(5-(8-(4-CARBAMOYL-3-FLUORO-PHENYL)-5-OXO-7-THIOXO-6,8-DIAZASPIRO(3.4)OCTAN-6-YL)-3-(TRIFLUOROMETHYL)-2-PYRIDYL)-4,5-DIHYDROTHIAZOLE-4-CARBONYL)AMINO)ACETIC ACID

Structure Search

SMILES

NC(=O)C1=CC=C(C=C1F)N2C(=S)N(C(=O)C23CCC3)C4=CC(=C(N=C4)C5=NC(CS5)C(=O)NCC(O)=O)C(F)(F)F

InChI

InChIKey=PQKBLDGEFMBHGP-UHFFFAOYSA-N

InChI=1S/C25H20F4N6O5S2/c26-15-7-11(2-3-13(15)19(30)38)35-23(41)34(22(40)24(35)4-1-5-24)12-6-14(25(27,28)29)18(31-8-12)21-33-16(10-42-21)20(39)32-9-17(36)37/h2-3,6-8,16H,1,4-5,9-10H2,(H2,30,38)(H,32,39)(H,36,37)

HIDE SMILES / InChI

Molecular Formula	C25H20F4N6O5S2
Molecular Weight	624.587
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 `Wed Apr 02 08:04:43 GMT 2025` Edited by `admin` on `Wed Apr 02 08:04:43 GMT 2025`
Record UNII	EZ479S6645
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-((2-(5-(8-(4-CARBAMOYL-3-FLUORO-PHENYL)-5-OXO-7-THIOXO-6,8-DIAZASPIRO(3.4)OCTAN-6-YL)-3-(TRIFLUOROMETHYL)-2-PYRIDYL)-4,5-DIHYDROTHIAZOLE-4-CARBONYL)AMINO)ACETIC ACID

Systematic Name

English

APALUTAMIDE METABOLITE M12

Preferred Name

English

Code System Code Type Description

FDA UNII

EZ479S6645

Created by admin on Wed Apr 02 08:04:43 GMT 2025 , Edited by admin on Wed Apr 02 08:04:43 GMT 2025

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PUBCHEM

165412047

Created by admin on Wed Apr 02 08:04:43 GMT 2025 , Edited by admin on Wed Apr 02 08:04:43 GMT 2025

PRIMARY

Related Record Type Details


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Apalutamide

PARENT -> METABOLITE

Qualification:

URINE