Vitas-M small molecule compound
3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-(4-methoxyphenyl)-N-[(3-methyl-1H-pyrazol-4-yl)methyl]propanamide
Catalog ID
STL552105
SMILES COc1ccc(cc1)C(c1oc(C)cc(=O)c1O)CC(=O)NCc1c[nH]nc1C
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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 C21H23N3O5 MW 397.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5/c1-12-8-18(25)20(27)21(29-12)17(14-4-6-16(28-3)7-5-14)9-19(26)22-10-15-11-23-24-13(15)2/h4-8,11,17,27H,9-10H2,1-3H3,(H,22,26)(H,23,24)InChIKey
XINXXRZZHDSJFN-UHFFFAOYSA-NSynonyms
135640399
3(3hydroxy6methyl4oxo4Hpyran2yl)3(4methoxyphenyl)N((3methyl1Hpyrazol4yl)methyl)propanamide
3(3hydroxy6methyl4oxo4Hpyran2yl)3(4methoxyphenyl)N((5methyl1Hpyrazol4yl)methyl)propanamide
3(3hydroxy6methyl4oxopyran2yl)3(4methoxyphenyl)~(N)((5methyl1~(H)pyrazol4yl)methyl)propanamide
COc1ccc(cc1)C(c1oc(C)cc(=O)c1O)CC(=O)NCc1cn(nH)c1C
InChI=1SC21H23N3O5c112818(25)20(27)21(2912)17(144616(283)7514)919(26)22101511232413(15)2h48111727H910H213H3(H2226)(H2324)
MFCD31758354
ZINC001547138960
ZINC001547138961
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