Vitas-M small molecule compound

N~2~-{[4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)tetrahydro-2H-thiopyran-4-yl]acetyl}-L-leucinamide

Catalog ID
STL561840
SMILES CC(C[C@@H](C(=O)N)NC(=O)CC1(CCSCC1)c1oc(C)cc(=O)c1O)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 C19H28N2O5S MW 396.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N2O5S/c1-11(2)8-13(18(20)25)21-15(23)10-19(4-6-27-7-5-19)17-16(24)14(22)9-12(3)26-17/h9,11,13,24H,4-8,10H2,1-3H3,(H2,20,25)(H,21,23)/t13-/m0/s1
InChIKey
VBRGGCXMECYMSL-ZDUSSCGKSA-N
Synonyms

(2S)2((2(4(3hydroxy6methyl4oxopyran2yl)thian4yl)acetyl)amino)4methylpentanamide
(S)2(2(4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hthiopyran4yl)acetamido)4methylpentanamide
145705194
CC(C(C@@H)(C(=O)N)NC(=O)CC1(CCSCC1)c1oc(C)cc(=O)c1O)C
InChI=1SC19H28N2O5Sc111(2)813(18(20)25)2115(23)1019(46277519)1716(24)14(22)912(3)2617h9111324H4810H213H3(H22025)(H2123)t13m0s1
MFCD32650901
N~2~((4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hthiopyran4yl)acetyl)Lleucinamide
N2((4(3HYDROXY6METHYL4OXO4HPYRAN2YL)TETRAHYDRO2HTHIOPYRAN4YL)ACETYL)LLEUCINAMIDE
ZINC001848443091

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.