CP-373943

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H19N3O4
Molecular Weight	365.3826
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OCCOC1=CC2=C(C=C1OCCO)C(NC3=CC(=CC=C3)C#C)=NC=N2

InChI

InChIKey=YWSAEKIQJPQSDJ-UHFFFAOYSA-N

InChI=1S/C20H19N3O4/c1-2-14-4-3-5-15(10-14)23-20-16-11-18(26-8-6-24)19(27-9-7-25)12-17(16)21-13-22-20/h1,3-5,10-13,24-25H,6-9H2,(H,21,22,23)

HIDE SMILES / InChI

Molecular Formula	C20H19N3O4
Molecular Weight	365.3826
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Thu Jul 06 14:50:57 UTC 2023` Edited by `admin` on `Thu Jul 06 14:50:57 UTC 2023`
Record UNII	92T0F45VE1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CP-373943

Common Name

English

ETHANOL, 2-((4-((3-ETHYNYLPHENYL)AMINO)-6-(2-HYDROXYETHOXY)-7-QUINAZOLINYL)OXY)-

Systematic Name

English

OSI-943

Common Name

English

ETHANOL, 2,2'-((4-((3-ETHYNYLPHENYL)AMINO)-6,7-QUINAZOLINEDIYL)BIS(OXY))BIS-

Systematic Name

English

ERLOTINIB METABOLITE M12

Common Name

English

2-(4-(3-ETHYNYLANILINO)-7-(2-HYDROXYETHOXY)QUINAZOLIN-6-YL)OXYETHANOL

Systematic Name

English

Code System Code Type Description

CAS

183321-84-8

Created by admin on Thu Jul 06 14:50:57 UTC 2023 , Edited by admin on Thu Jul 06 14:50:57 UTC 2023

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EPA CompTox

DTXSID40581464

Created by admin on Thu Jul 06 14:50:57 UTC 2023 , Edited by admin on Thu Jul 06 14:50:57 UTC 2023

PRIMARY

PUBCHEM

16045656

Created by admin on Thu Jul 06 14:50:57 UTC 2023 , Edited by admin on Thu Jul 06 14:50:57 UTC 2023

PRIMARY

FDA UNII

92T0F45VE1

Created by admin on Thu Jul 06 14:50:57 UTC 2023 , Edited by admin on Thu Jul 06 14:50:57 UTC 2023

PRIMARY

Related Record Type Details


					J4T82NDH7E

ERLOTINIB

PARENT -> METABOLITE

Interaction Type:

MAJOR