Ethyl 3-[[2-chloro-9-(phenylmethyl)-9H-purin-6-yl]amino]benzoate

CCC(=O)OC1=CC(NC2=NC(Cl)=NC3=C2N=CN3CC4=CC=CC=C4)=CC=C1

InChIKey=LLOOKIGRINYNMN-UHFFFAOYSA-N

InChI=1S/C21H18ClN5O2/c1-2-17(28)29-16-10-6-9-15(11-16)24-19-18-20(26-21(22)25-19)27(13-23-18)12-14-7-4-3-5-8-14/h3-11,13H,2,12H2,1H3,(H,24,25,26)

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

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:25:25 GMT 2025` Edited by `admin` on `Tue Apr 01 16:25:25 GMT 2025`
Record UNII	N8X9N5Q4WJ
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

Phenol, 3-((2-chloro-9-(phenylmethyl)-9H-purin-6-yl)amino)-, propanoate (ester)

Preferred Name

English

Ethyl 3-[[2-chloro-9-(phenylmethyl)-9H-purin-6-yl]amino]benzoate

Systematic Name

English

Benzoic acid, 3-[[2-chloro-9-(phenylmethyl)-9H-purin-6-yl]amino]-, ethyl ester

Systematic Name

English

Code System Code Type Description

CAS

125802-60-0

Created by admin on Tue Apr 01 16:25:25 GMT 2025 , Edited by admin on Tue Apr 01 16:25:25 GMT 2025

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EPA CompTox

DTXSID10925290

Created by admin on Tue Apr 01 16:25:25 GMT 2025 , Edited by admin on Tue Apr 01 16:25:25 GMT 2025

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PUBCHEM

5271945

Created by admin on Tue Apr 01 16:25:25 GMT 2025 , Edited by admin on Tue Apr 01 16:25:25 GMT 2025

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FDA UNII

N8X9N5Q4WJ

Created by admin on Tue Apr 01 16:25:25 GMT 2025 , Edited by admin on Tue Apr 01 16:25:25 GMT 2025

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