Vitas-M small molecule compound

2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]butanoic acid

Catalog ID
STK365113
SMILES CCC(C(=O)O)Sc1nc(N)cc(n1)N

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C8H12N4O2S MW 228.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H12N4O2S/c1-2-4(7(13)14)15-8-11-5(9)3-6(10)12-8/h3-4H,2H2,1H3,(H,13,14)(H4,9,10,11,12)
InChIKey
SXVWYWGXRFRYMV-UHFFFAOYSA-N
Synonyms
436088-61-8
2((46DIAMINOPYRIMIDIN2YL)SULFANYL)BUTANOICACID
2(46DIAMINOPYRIMIDIN2YL)SULFANYLBUTANOICACID
2(46DIAMINOPYRIMIDIN2YLSULFANYL)BUTYRICACI
2(46DIAMINOPYRIMIDIN2YLSULFANYL)BUTYRICACID
2(46DIAMINOPYRIMIDIN2YLTHIO)BUTANOICACID
436088618
CCC(C(=O)O)SC1=NC(=CC(=N1)N)N
InChI=1SC8H12N4O2Sc124(7(13)14)158115(9)36(10)128h34H2H21H3(H1314)(H49101112)
MFCD03043400
ZINC000000317193
ZINC000000317199

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.