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

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H12N6S
Molecular Weight	284.34
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

NC1=NC(N)=C2N=C(CSC3=CC=CC=C3)C=NC2=N1

InChI

InChIKey=ZJOATKLQTCGUSP-UHFFFAOYSA-N

InChI=1S/C13H12N6S/c14-11-10-12(19-13(15)18-11)16-6-8(17-10)7-20-9-4-2-1-3-5-9/h1-6H,7H2,(H4,14,15,16,18,19)

HIDE SMILES / InChI

Molecular Formula	C13H12N6S
Molecular Weight	284.34
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 19:47:20 GMT 2025` Edited by `admin` on `Tue Apr 01 19:47:20 GMT 2025`
Record UNII	D5VU87D2MN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Systematic Name

English

NSC-232965

Preferred Name

English

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

Systematic Name

English

Code System Code Type Description

FDA UNII

D5VU87D2MN

Created by admin on Tue Apr 01 19:47:20 GMT 2025 , Edited by admin on Tue Apr 01 19:47:20 GMT 2025

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NSC

232965

Created by admin on Tue Apr 01 19:47:20 GMT 2025 , Edited by admin on Tue Apr 01 19:47:20 GMT 2025

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CAS

57963-58-3

Created by admin on Tue Apr 01 19:47:20 GMT 2025 , Edited by admin on Tue Apr 01 19:47:20 GMT 2025

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PUBCHEM

314604

Created by admin on Tue Apr 01 19:47:20 GMT 2025 , Edited by admin on Tue Apr 01 19:47:20 GMT 2025

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EPA CompTox

DTXSID30206699

Created by admin on Tue Apr 01 19:47:20 GMT 2025 , Edited by admin on Tue Apr 01 19:47:20 GMT 2025

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