5-(4-Chlorophenoxy)-2,4-pyrimidinediamine

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H9ClN4O
Molecular Weight	236.658
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-(4-Chlorophenoxy)-2,4-pyrimidinediamine

Structure Search

SMILES

NC1=NC(N)=C(OC2=CC=C(Cl)C=C2)C=N1

InChI

InChIKey=APTANHMYYZPGNW-UHFFFAOYSA-N

InChI=1S/C10H9ClN4O/c11-6-1-3-7(4-2-6)16-8-5-14-10(13)15-9(8)12/h1-5H,(H4,12,13,14,15)

HIDE SMILES / InChI

Molecular Formula	C10H9ClN4O
Molecular Weight	236.658
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:56:18 GMT 2023` Edited by `admin` on `Sat Dec 16 12:56:18 GMT 2023`
Record UNII	A3RDY437WP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-(4-Chlorophenoxy)-2,4-pyrimidinediamine

Systematic Name

English

Pyrimidine, 2,4-diamino-5-(p-chlorophenoxy)-

Systematic Name

English

BW 48-122

Common Name

English

2,4-Pyrimidinediamine, 5-(4-chlorophenoxy)-

Systematic Name

English

NSC-408103

Code

English

Code System Code Type Description

NSC

408103

Created by admin on Sat Dec 16 12:56:18 GMT 2023 , Edited by admin on Sat Dec 16 12:56:18 GMT 2023

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EPA CompTox

DTXSID30223543

Created by admin on Sat Dec 16 12:56:18 GMT 2023 , Edited by admin on Sat Dec 16 12:56:18 GMT 2023

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CAS

7331-20-6

Created by admin on Sat Dec 16 12:56:18 GMT 2023 , Edited by admin on Sat Dec 16 12:56:18 GMT 2023

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FDA UNII

A3RDY437WP

Created by admin on Sat Dec 16 12:56:18 GMT 2023 , Edited by admin on Sat Dec 16 12:56:18 GMT 2023

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PUBCHEM

72999

Created by admin on Sat Dec 16 12:56:18 GMT 2023 , Edited by admin on Sat Dec 16 12:56:18 GMT 2023

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