5-(8-(4-CARBAMOYL-3-FLUORO-PHENYL)-5-OXO-7-THIOXO-6,8-DIAZASPIRO(3.4)OCTAN-6-YL)-3-(TRIFLUOROMETHYL)PYRIDINE-2-CARBOXAMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H15F4N5O3S
Molecular Weight	481.423
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-(8-(4-CARBAMOYL-3-FLUORO-PHENYL)-5-OXO-7-THIOXO-6,8-DIAZASPIRO(3.4)OCTAN-6-YL)-3-(TRIFLUOROMETHYL)PYRIDINE-2-CARBOXAMIDE

Structure Search

SMILES

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

InChI

InChIKey=KKYUHCUBYMQZOJ-UHFFFAOYSA-N

InChI=1S/C20H15F4N5O3S/c21-13-7-9(2-3-11(13)15(25)30)29-18(33)28(17(32)19(29)4-1-5-19)10-6-12(20(22,23)24)14(16(26)31)27-8-10/h2-3,6-8H,1,4-5H2,(H2,25,30)(H2,26,31)

HIDE SMILES / InChI

Molecular Formula	C20H15F4N5O3S
Molecular Weight	481.423
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 `Sat Dec 16 16:10:18 GMT 2023` Edited by `admin` on `Sat Dec 16 16:10:18 GMT 2023`
Record UNII	T8AA7U442W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-(8-(4-CARBAMOYL-3-FLUORO-PHENYL)-5-OXO-7-THIOXO-6,8-DIAZASPIRO(3.4)OCTAN-6-YL)-3-(TRIFLUOROMETHYL)PYRIDINE-2-CARBOXAMIDE

Systematic Name

English

APALUTAMIDE METABOLITE M15

Common Name

English

Code System Code Type Description

FDA UNII

T8AA7U442W

Created by admin on Sat Dec 16 16:10:18 GMT 2023 , Edited by admin on Sat Dec 16 16:10:18 GMT 2023

PRIMARY

PUBCHEM

156596557

Created by admin on Sat Dec 16 16:10:18 GMT 2023 , Edited by admin on Sat Dec 16 16:10:18 GMT 2023

PRIMARY

Related Record Type Details


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APALUTAMIDE

PARENT -> METABOLITE

Interaction Type:

TRACE

Qualification:

FECAL


					4T36H88UA7

APALUTAMIDE

PARENT -> METABOLITE

Comments:

after oral administration of 240 mg of apalutamide in 0-1680 hours

Qualification:

URINE

Amount: