4-(4-(3-(4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)UREIDO)-3-(4-(3-(4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)UREIDO)-3-FLUOROPHENOXY)PHENOXY)-N-METHYLPICOLINAMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C35H23Cl2F7N6O5
Molecular Weight	811.489
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(4-(3-(4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)UREIDO)-3-(4-(3-(4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)UREIDO)-3-FLUOROPHENOXY)PHENOXY)-N-METHYLPICOLINAMIDE

Structure Search

SMILES

CNC(=O)C1=CC(OC2=CC(OC3=CC(F)=C(NC(=O)NC4=CC(=C(Cl)C=C4)C(F)(F)F)C=C3)=C(NC(=O)NC5=CC(=C(Cl)C=C5)C(F)(F)F)C=C2)=CC=N1

InChI

InChIKey=QRLYAHWXHYKLQM-UHFFFAOYSA-N

InChI=1S/C35H23Cl2F7N6O5/c1-45-31(51)29-15-21(10-11-46-29)54-20-5-9-28(50-33(53)48-18-3-7-25(37)23(13-18)35(42,43)44)30(16-20)55-19-4-8-27(26(38)14-19)49-32(52)47-17-2-6-24(36)22(12-17)34(39,40)41/h2-16H,1H3,(H,45,51)(H2,47,49,52)(H2,48,50,53)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

4-(4-(3-(4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)UREIDO)-3-(4-(3-(4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)UREIDO)-3-FLUOROPHENOXY)PHENOXY)-N-METHYLPICOLINAMIDE

Systematic Name

English

REGORAFENIB MONOHYDRATE IMPURITY E [EP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

125337923

Created by admin on Sat Dec 16 10:39:49 GMT 2023 , Edited by admin on Sat Dec 16 10:39:49 GMT 2023

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CAS

2098799-13-2

Created by admin on Sat Dec 16 10:39:49 GMT 2023 , Edited by admin on Sat Dec 16 10:39:49 GMT 2023

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FDA UNII

GY0A8K2GHF

Created by admin on Sat Dec 16 10:39:49 GMT 2023 , Edited by admin on Sat Dec 16 10:39:49 GMT 2023

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SUBSTANCE RECORD


					GY0A8K2GHF

4-(4-(3-(4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)UREIDO)-3-(4-(3-(4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)UREIDO)-3-FLUOROPHENOXY)PHENOXY)-N-METHYLPICOLINAMIDE