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-CARBOXYLIC ACID

Details

Stereochemistry	RACEMIC
Molecular Formula	C23H17F4N5O4S2
Molecular Weight	567.536
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 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-CARBOXYLIC 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)=O)C(F)(F)F

InChI

InChIKey=NPCMQJLJVCOOFQ-UHFFFAOYSA-N

InChI=1S/C23H17F4N5O4S2/c24-14-7-10(2-3-12(14)17(28)33)32-21(37)31(20(36)22(32)4-1-5-22)11-6-13(23(25,26)27)16(29-8-11)18-30-15(9-38-18)19(34)35/h2-3,6-8,15H,1,4-5,9H2,(H2,28,33)(H,34,35)

HIDE SMILES / InChI

Molecular Formula	C23H17F4N5O4S2
Molecular Weight	567.536
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 `Sat Dec 16 16:38:40 GMT 2023` Edited by `admin` on `Sat Dec 16 16:38:40 GMT 2023`
Record UNII	GB8AZB2SW9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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-CARBOXYLIC ACID

Systematic Name

English

APALUTAMIDE METABOLITE M14

Common Name

English

Code System Code Type Description

FDA UNII

GB8AZB2SW9

Created by admin on Sat Dec 16 16:38:40 GMT 2023 , Edited by admin on Sat Dec 16 16:38:40 GMT 2023

PRIMARY

PUBCHEM

165412051

Created by admin on Sat Dec 16 16:38:40 GMT 2023 , Edited by admin on Sat Dec 16 16:38:40 GMT 2023

PRIMARY

Related Record Type Details


					4T36H88UA7

APALUTAMIDE

PARENT -> METABOLITE

Qualification:

FECAL; URINE