6-((PHENYLAMINO)METHYL)-2,4-PTERIDINEDIAMINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H13N7
Molecular Weight	267.2892
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6-((PHENYLAMINO)METHYL)-2,4-PTERIDINEDIAMINE

Structure Search

SMILES

NC1=NC(N)=C2N=C(CNC3=CC=CC=C3)C=NC2=N1

InChI

InChIKey=KWBYHDAETXMHLI-UHFFFAOYSA-N

InChI=1S/C13H13N7/c14-11-10-12(20-13(15)19-11)17-7-9(18-10)6-16-8-4-2-1-3-5-8/h1-5,7,16H,6H2,(H4,14,15,17,19,20)

HIDE SMILES / InChI

Molecular Formula	C13H13N7
Molecular Weight	267.2892
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 `Tue Apr 01 19:36:44 GMT 2025` Edited by `admin` on `Tue Apr 01 19:36:44 GMT 2025`
Record UNII	L0OJD6HGW4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-235776

Preferred Name

English

6-((PHENYLAMINO)METHYL)-2,4-PTERIDINEDIAMINE

Systematic Name

English

2,4-PTERIDINEDIAMINE, 6-((PHENYLAMINO)METHYL)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID20215230

Created by admin on Tue Apr 01 19:36:44 GMT 2025 , Edited by admin on Tue Apr 01 19:36:44 GMT 2025

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CAS

64920-88-3

Created by admin on Tue Apr 01 19:36:44 GMT 2025 , Edited by admin on Tue Apr 01 19:36:44 GMT 2025

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NSC

235776

Created by admin on Tue Apr 01 19:36:44 GMT 2025 , Edited by admin on Tue Apr 01 19:36:44 GMT 2025

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PUBCHEM

428342

Created by admin on Tue Apr 01 19:36:44 GMT 2025 , Edited by admin on Tue Apr 01 19:36:44 GMT 2025

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FDA UNII

L0OJD6HGW4

Created by admin on Tue Apr 01 19:36:44 GMT 2025 , Edited by admin on Tue Apr 01 19:36:44 GMT 2025

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