Vitas-M small molecule compound
N~3~-{[4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)tetrahydro-2H-thiopyran-4-yl]acetyl}-N-pyridin-2-yl-beta-alaninamide
Catalog ID
STL559166
SMILES O=C(CC1(CCSCC1)c1oc(C)cc(=O)c1O)NCCC(=O)Nc1ccccn1
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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 C21H25N3O5S MW 431.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O5S/c1-14-12-15(25)19(28)20(29-14)21(6-10-30-11-7-21)13-18(27)23-9-5-17(26)24-16-4-2-3-8-22-16/h2-4,8,12,28H,5-7,9-11,13H2,1H3,(H,23,27)(H,22,24,26)InChIKey
MTMYQQMVVHIYDQ-UHFFFAOYSA-NSynonyms
139029628
3((2(4(3hydroxy6methyl4oxopyran2yl)thian4yl)acetyl)amino)Npyridin2ylpropanamide
3(2(4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hthiopyran4yl)acetamido)N(pyridin2yl)propanamide
InChI=1SC21H25N3O5Sc1141215(25)19(28)20(2914)21(6103011721)1318(27)239517(26)241642382216h2481228H5791113H21H3(H2327)(H222426)
MFCD32221033
N~3~((4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hthiopyran4yl)acetyl)Npyridin2ylbetaalaninamide
N3((4(3HYDROXY6METHYL4OXO4HPYRAN2YL)TETRAHYDRO2HTHIOPYRAN4YL)ACETYL)NPYRIDIN2YLBETAALANINAMIDE
ZINC001776111300
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