Lapatinib metabolite M6

Details

Stereochemistry	ACHIRAL
Molecular Formula	C29H24ClFN4O5S
Molecular Weight	595.041
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CS(=O)(=O)CC\[N+]([O-])=C\C1=CC=C(O1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(Cl)=C(OCC5=CC(F)=CC=C5)C=C4

InChI

InChIKey=TUEKUHASBFBNOO-NKHVPTTDSA-N

InChI=1S/C29H24ClFN4O5S/c1-41(37,38)12-11-35(36)16-23-7-10-27(40-23)20-5-8-26-24(14-20)29(33-18-32-26)34-22-6-9-28(25(30)15-22)39-17-19-3-2-4-21(31)13-19/h2-10,13-16,18H,11-12,17H2,1H3,(H,32,33,34)/b35-16-

HIDE SMILES / InChI

Molecular Formula	C29H26ClFN4O4S
Molecular Weight	581.058
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 `Wed Apr 02 04:33:38 GMT 2025` Edited by `admin` on `Wed Apr 02 04:33:38 GMT 2025`
Record UNII	E5KX9XN7KK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]oxidoimino]methyl]-2-furanyl]-

Preferred Name

English

Lapatinib metabolite M6

Common Name

English

N-[3-Chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]oxidoimino]methyl]-2-furanyl]-4-quinazolinamine

Systematic Name

English

Code System Code Type Description

FDA UNII

E5KX9XN7KK

Created by admin on Wed Apr 02 04:33:38 GMT 2025 , Edited by admin on Wed Apr 02 04:33:38 GMT 2025

PRIMARY

PUBCHEM

118753138

Created by admin on Wed Apr 02 04:33:38 GMT 2025 , Edited by admin on Wed Apr 02 04:33:38 GMT 2025

PRIMARY

CAS

1415561-66-8

Created by admin on Wed Apr 02 04:33:38 GMT 2025 , Edited by admin on Wed Apr 02 04:33:38 GMT 2025

PRIMARY

Related Record Type Details


					0VUA21238F

Lapatinib

PARENT -> METABOLITE

Amount: