BAY-751098

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H13ClF4N4O3
Molecular Weight	468.789
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC(=O)C1=NC=CC(OC2=CC(F)=C(NC(=O)NC3=CC=C(Cl)C(=C3)C(F)(F)F)C=C2)=C1

InChI

InChIKey=UJAPQTJRMGFPQS-UHFFFAOYSA-N

InChI=1S/C20H13ClF4N4O3/c21-14-3-1-10(7-13(14)20(23,24)25)28-19(31)29-16-4-2-11(8-15(16)22)32-12-5-6-27-17(9-12)18(26)30/h1-9H,(H2,26,30)(H2,28,29,31)

HIDE SMILES / InChI

Approval Year

Patents

Name

Type

Language

BAY-751098

Common Name

English

REGORAFENIB METABOLITE M4

Common Name

English

4-(4-((4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)CARBAMOYLAMINO)-3-FLUORO-PHENOXY)PYRIDINE-2-CARBOXAMIDE

Systematic Name

English

2-PYRIDINECARBOXAMIDE, 4-(4-((((4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)AMINO)CARBONYL)AMINO)-3-FLUOROPHENOXY)-

Systematic Name

English

Code System Code Type Description

CAS

1343498-72-5

Created by admin on Sat Dec 16 09:09:56 GMT 2023 , Edited by admin on Sat Dec 16 09:09:56 GMT 2023

PRIMARY

PUBCHEM

53491672

Created by admin on Sat Dec 16 09:09:56 GMT 2023 , Edited by admin on Sat Dec 16 09:09:56 GMT 2023

PRIMARY

FDA UNII

58I22S7HYD

Created by admin on Sat Dec 16 09:09:56 GMT 2023 , Edited by admin on Sat Dec 16 09:09:56 GMT 2023

PRIMARY

PARENT (METABOLITE INACTIVE)


					24T2A1DOYB

REGORAFENIB ANHYDROUS

SUBSTANCE RECORD


					58I22S7HYD

BAY-751098