2(1H)-QUINAZOLINONE, 4-((3-CHLORO-4-HYDROXYPHENYL)AMINO)-6-(5-(((2-(METHYLSULFONYL)ETHYL)AMINO)METHYL)-2-FURANYL)-

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H21ClN4O5S
Molecular Weight	488.944
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2(1H)-QUINAZOLINONE, 4-((3-CHLORO-4-HYDROXYPHENYL)AMINO)-6-(5-(((2-(METHYLSULFONYL)ETHYL)AMINO)METHYL)-2-FURANYL)-

Structure Search

SMILES

CS(=O)(=O)CCNCC1=CC=C(O1)C2=CC=C3N=C(O)N=C(NC4=CC(Cl)=C(O)C=C4)C3=C2

InChI

InChIKey=AUAGHDXQEKFWSG-UHFFFAOYSA-N

InChI=1S/C22H21ClN4O5S/c1-33(30,31)9-8-24-12-15-4-7-20(32-15)13-2-5-18-16(10-13)21(27-22(29)26-18)25-14-3-6-19(28)17(23)11-14/h2-7,10-11,24,28H,8-9,12H2,1H3,(H2,25,26,27,29)

HIDE SMILES / InChI

Molecular Formula	C22H21ClN4O5S
Molecular Weight	488.944
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 14:38:52 UTC 2023` Edited by `admin` on `Sat Dec 16 14:38:52 UTC 2023`
Record UNII	5T9BGR2UCX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2(1H)-QUINAZOLINONE, 4-((3-CHLORO-4-HYDROXYPHENYL)AMINO)-6-(5-(((2-(METHYLSULFONYL)ETHYL)AMINO)METHYL)-2-FURANYL)-

Systematic Name

English

LAPATINIB METABOLITE M3

Common Name

English

4-((3-CHLORO-4-HYDROXYPHENYL)AMINO)-6-(5-(((2-(METHYLSULFONYL)ETHYL)AMINO)METHYL)-2-FURANYL)-2(1H)-QUINAZOLINONE

Systematic Name

English

Code System Code Type Description

CAS

1415561-30-6

Created by admin on Sat Dec 16 14:38:53 UTC 2023 , Edited by admin on Sat Dec 16 14:38:53 UTC 2023

PRIMARY

FDA UNII

5T9BGR2UCX

Created by admin on Sat Dec 16 14:38:53 UTC 2023 , Edited by admin on Sat Dec 16 14:38:53 UTC 2023

PRIMARY

PUBCHEM

118753081

Created by admin on Sat Dec 16 14:38:53 UTC 2023 , Edited by admin on Sat Dec 16 14:38:53 UTC 2023

PRIMARY

Related Record Type Details


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LAPATINIB

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