Vitas-M small molecule compound
2-[4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)tetrahydro-2H-thiopyran-4-yl]-N-[(4-hydroxy-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]acetamide
Catalog ID
STL559851
SMILES O=C(CC1(CCSCC1)c1oc(C)cc(=O)c1O)NCc1nc(O)c2c(n1)n(nc2)c1ccccc1
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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 C25H25N5O5S MW 507.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O5S/c1-15-11-18(31)21(33)22(35-15)25(7-9-36-10-8-25)12-20(32)26-14-19-28-23-17(24(34)29-19)13-27-30(23)16-5-3-2-4-6-16/h2-6,11,13,33H,7-10,12,14H2,1H3,(H,26,32)(H,28,29,34)InChIKey
LXDUOOUPQJJDPV-UHFFFAOYSA-NSynonyms
139030023
2(4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hthiopyran4yl)N((4hydroxy1phenyl1Hpyrazolo(34d)pyrimidin6yl)methyl)acetamide
2(4(3hydroxy6methyl4oxopyran2yl)thian4yl)N((4oxo1phenyl5Hpyrazolo(34d)pyrimidin6yl)methyl)acetamide
InChI=1SC25H25N5O5Sc1151118(31)21(33)22(3515)25(793610825)1220(32)261419282317(24(34)2919)132730(23)165324616h26111333H7101214H21H3(H2632)(H282934)
MFCD32221674
ZINC001776111698
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