Vitas-M small molecule compound

4-hydroxy-1-methyl-7,8,9,10-tetrahydro-6H-[1,3]thiazocino[2,3-f]purin-2(1H)-one

Catalog ID
STK643127
SMILES O=c1nc(O)c2c(n1C)nc1n2CCCCCS1

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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 C11H14N4O2S MW 266.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H14N4O2S/c1-14-8-7(9(16)13-10(14)17)15-5-3-2-4-6-18-11(15)12-8/h2-6H2,1H3,(H,13,16,17)
InChIKey
IGKRUASVZKVVLL-UHFFFAOYSA-N
Synonyms
312941-74-5
1methyl78910tetrahydro6Hpurino(87b)(13)thiazocine24dione
312941745
4hydroxy1methyl78910tetrahydro6H(13)thiazocino(23f)purin2(1H)one
CN1C2=C(C(=O)NC1=O)N3CCCCCSC3=N2
InChI=1SC11H14N4O2Sc11487(9(16)1310(14)17)15532461811(15)128h26H21H3(H131617)
MFCD18163202
ZINC000000496244
ZINC00496244
ZINC496244

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Available files

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