N-DESMETHYL N-METHOXY REGORAFENIB

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H15ClF4N4O4
Molecular Weight	498.815
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-DESMETHYL N-METHOXY REGORAFENIB

Structure Search

SMILES

CONC(=O)C1=CC(OC2=CC(F)=C(NC(=O)NC3=CC(=C(Cl)C=C3)C(F)(F)F)C=C2)=CC=N1

InChI

InChIKey=FWSOHJFHAGRULY-UHFFFAOYSA-N

InChI=1S/C21H15ClF4N4O4/c1-33-30-19(31)18-10-13(6-7-27-18)34-12-3-5-17(16(23)9-12)29-20(32)28-11-2-4-15(22)14(8-11)21(24,25)26/h2-10H,1H3,(H,30,31)(H2,28,29,32)

HIDE SMILES / InChI

Molecular Formula	C21H15ClF4N4O4
Molecular Weight	498.815
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 08:57:49 GMT 2023` Edited by `admin` on `Sat Dec 16 08:57:49 GMT 2023`
Record UNII	RT416XWQ4I
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-DESMETHYL N-METHOXY REGORAFENIB

Common Name

English

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

Systematic Name

English

Code System Code Type Description

FDA UNII

RT416XWQ4I

Created by admin on Sat Dec 16 08:57:49 GMT 2023 , Edited by admin on Sat Dec 16 08:57:49 GMT 2023

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PUBCHEM

44241263

Created by admin on Sat Dec 16 08:57:49 GMT 2023 , Edited by admin on Sat Dec 16 08:57:49 GMT 2023

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CAS

1187944-98-4

Created by admin on Sat Dec 16 08:57:49 GMT 2023 , Edited by admin on Sat Dec 16 08:57:49 GMT 2023

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