Afatinib, (2Z)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H25ClFN5O3
Molecular Weight	485.938
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN(C)C\C=C/C(=O)NC1=CC2=C(NC3=CC=C(F)C(Cl)=C3)N=CN=C2C=C1O[C@H]4CCOC4

InChI

InChIKey=ULXXDDBFHOBEHA-QGZUEGPWSA-N

InChI=1S/C24H25ClFN5O3/c1-31(2)8-3-4-23(32)30-21-11-17-20(12-22(21)34-16-7-9-33-13-16)27-14-28-24(17)29-15-5-6-19(26)18(25)10-15/h3-6,10-12,14,16H,7-9,13H2,1-2H3,(H,30,32)(H,27,28,29)/b4-3-/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H25ClFN5O3
Molecular Weight	485.938
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	8VCD8UD2U3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2Z)-Afatinib

Preferred Name

English

Afatinib, (2Z)-

Common Name

English

(Z)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide

Systematic Name

English

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

Systematic Name

English

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

Systematic Name

English

Code System Code Type Description

FDA UNII

8VCD8UD2U3

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

1680184-59-1

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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PUBCHEM

97041548

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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EPA CompTox

DTXSID501103129

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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