Neratinib, (Z)-

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H29ClN6O3
Molecular Weight	557.043
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCOC1=CC2=NC=C(C#N)C(NC3=CC=C(OCC4=NC=CC=C4)C(Cl)=C3)=C2C=C1NC(=O)\C=C/CN(C)C

InChI

InChIKey=JWNPDZNEKVCWMY-CLFYSBASSA-N

InChI=1S/C30H29ClN6O3/c1-4-39-28-16-25-23(15-26(28)36-29(38)9-7-13-37(2)3)30(20(17-32)18-34-25)35-21-10-11-27(24(31)14-21)40-19-22-8-5-6-12-33-22/h5-12,14-16,18H,4,13,19H2,1-3H3,(H,34,35)(H,36,38)/b9-7-

HIDE SMILES / InChI

Molecular Formula	C30H29ClN6O3
Molecular Weight	557.043
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:09:16 GMT 2025` Edited by `admin` on `Wed Apr 02 12:09:16 GMT 2025`
Record UNII	5TF6MZ2DQ9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

cis-Neratinib

Preferred Name

English

Neratinib, (Z)-

Common Name

English

(Z)-N-(4-((3-Chloro-4-(pyridin-2-ylmethoxy)phenyl)amino)-3-cyano-7-ethoxyquinolin-6-yl)-4-(dimethylamino)but-2-enamide

Systematic Name

English

2-Butenamide, N-[4-[[3-chloro-4-(2-pyridinylmethoxy)phenyl]amino]-3-cyano-7-ethoxy-6-quinolinyl]-4-(dimethylamino)-, (2Z)-

Systematic Name

English

Code System Code Type Description

CAS

2186660-79-5

Created by admin on Wed Apr 02 12:09:16 GMT 2025 , Edited by admin on Wed Apr 02 12:09:16 GMT 2025

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FDA UNII

5TF6MZ2DQ9

Created by admin on Wed Apr 02 12:09:16 GMT 2025 , Edited by admin on Wed Apr 02 12:09:16 GMT 2025

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PUBCHEM

93473937

Created by admin on Wed Apr 02 12:09:16 GMT 2025 , Edited by admin on Wed Apr 02 12:09:16 GMT 2025

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