N-(4-((3-Chloro-4-fluorophenyl)amino)-7-((tetrahydrofuran-3-yl)oxy)quinazolin-6-yl)but-2-enamide, (S,E)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H20ClFN4O3
Molecular Weight	442.871
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of N-(4-((3-Chloro-4-fluorophenyl)amino)-7-((tetrahydrofuran-3-yl)oxy)quinazolin-6-yl)but-2-enamide, (S,E)-

Structure Search

SMILES

C\C=C\C(=O)NC1=C(O[C@H]2CCOC2)C=C3N=CN=C(NC4=CC(Cl)=C(F)C=C4)C3=C1

InChI

InChIKey=IRSLBGKNPBBZSA-HSWBROFVSA-N

InChI=1S/C22H20ClFN4O3/c1-2-3-21(29)28-19-9-15-18(10-20(19)31-14-6-7-30-11-14)25-12-26-22(15)27-13-4-5-17(24)16(23)8-13/h2-5,8-10,12,14H,6-7,11H2,1H3,(H,28,29)(H,25,26,27)/b3-2+/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H20ClFN4O3
Molecular Weight	442.871
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:37:37 GMT 2025` Edited by `admin` on `Wed Apr 02 17:37:37 GMT 2025`
Record UNII	M56A58DLR9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2E)-N-[4-[(3-Chloro-4-fluorophenyl)amino]-7-[[(3S)-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-2-butenamide

Preferred Name

English

N-(4-((3-Chloro-4-fluorophenyl)amino)-7-((tetrahydrofuran-3-yl)oxy)quinazolin-6-yl)but-2-enamide, (S,E)-

Systematic Name

English

2-Butenamide, N-[4-[(3-chloro-4-fluorophenyl)amino]-7-[[(3S)-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-, (2E)-

Systematic Name

English

(S,E)-N-(4-((3-Chloro-4-fluorophenyl)amino)-7-((tetrahydrofuran-3-yl)oxy)quinazolin-6-yl)but-2-enamide

Systematic Name

English

Code System Code Type Description

PUBCHEM

127256267

Created by admin on Wed Apr 02 17:37:37 GMT 2025 , Edited by admin on Wed Apr 02 17:37:37 GMT 2025

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CAS

2223677-64-1

Created by admin on Wed Apr 02 17:37:37 GMT 2025 , Edited by admin on Wed Apr 02 17:37:37 GMT 2025

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FDA UNII

M56A58DLR9

Created by admin on Wed Apr 02 17:37:37 GMT 2025 , Edited by admin on Wed Apr 02 17:37:37 GMT 2025

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