Vitas-M small molecule compound
6-hydroxy-3-methyl-8-(morpholin-4-yl)-7-[3-(pyrimidin-2-ylsulfanyl)propyl]-3,7-dihydro-2H-purin-2-one
Catalog ID
STL053872
SMILES Oc1nc(=O)n(c2c1n(CCCSc1ncccn1)c(n2)N1CCOCC1)C
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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 C17H21N7O3S MW 403.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N7O3S/c1-22-13-12(14(25)21-17(22)26)24(16(20-13)23-7-9-27-10-8-23)6-3-11-28-15-18-4-2-5-19-15/h2,4-5H,3,6-11H2,1H3,(H,21,25,26)InChIKey
BZBFNWYUAWUMEF-UHFFFAOYSA-NSynonyms
713127-80-13METHYL8MORPHOLIN4YL7(3PYRIMIDIN2YLSULFANYLPROPYL)PURINE26DIONE
6hydroxy3methyl8(morpholin4yl)7(3(pyrimidin2ylsulfanyl)propyl)37dihydro2Hpurin2one
713127801
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCOCC3)CCCSC4=NC=CC=N4
InChI=1SC17H21N7O3Sc1221312(14(25)2117(22)26)24(16(2013)23792710823)63112815184251915h245H3611H21H3(H212526)
MFCD05727069
ZINC000001758730
ZINC01758730
ZINC1758730
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