Vitas-M small molecule compound
2-[4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)tetrahydro-2H-thiopyran-4-yl]-N-{1-[5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]-2-phenylethyl}acetamide
Catalog ID
STL559430
SMILES COCc1nnc([nH]1)C(Cc1ccccc1)NC(=O)CC1(CCSCC1)c1oc(C)cc(=O)c1O
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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 C25H30N4O5S MW 498.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O5S/c1-16-12-19(30)22(32)23(34-16)25(8-10-35-11-9-25)14-21(31)26-18(13-17-6-4-3-5-7-17)24-27-20(15-33-2)28-29-24/h3-7,12,18,32H,8-11,13-15H2,1-2H3,(H,26,31)(H,27,28,29)InChIKey
BEVBHQFGIUHHJD-UHFFFAOYSA-NSynonyms
139029775
2(4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hthiopyran4yl)N(1(3(methoxymethyl)1H124triazol5yl)2phenylethyl)acetamide
2(4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hthiopyran4yl)N(1(5(methoxymethyl)4H124triazol3yl)2phenylethyl)acetamide
2(4(3hydroxy6methyl4oxopyran2yl)thian4yl)N(1(5(methoxymethyl)1H124triazol3yl)2phenylethyl)acetamide
COCc1n(nH)c(n1)C(Cc1ccccc1)NC(=O)CC1(CCSCC1)c1oc(C)cc(=O)c1O
InChI=1SC25H30N4O5Sc1161219(30)22(32)23(3416)25(8103511925)1421(31)2618(13176435717)242720(15332)282924h37121832H8111315H212H3(H2631)(H272829)
MFCD32221277
ZINC001776111150
ZINC001776111151
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