Vitas-M small molecule compound
3-[2-(1,3-benzodioxol-5-yl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4-hydroxy-6-methyl-2H-pyran-2-one
Catalog ID
STL525484
SMILES Cc1cc(O)c(c(=O)o1)C1=Nc2ccccc2SC(C1)c1ccc2c(c1)OCO2
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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 C22H17NO5S MW 407.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO5S/c1-12-8-16(24)21(22(25)28-12)15-10-20(29-19-5-3-2-4-14(19)23-15)13-6-7-17-18(9-13)27-11-26-17/h2-9,20,24H,10-11H2,1H3InChIKey
OZGALNWXNJTTKM-UHFFFAOYSA-NSynonyms
374704-54-8(3E)3(2(13BENZODIOXOL5YL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
(3Z)3(2(13BENZODIOXOL5YL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
135400381
3(2(13benzodioxol5yl)23dihydro15benzothiazepin4yl)4hydroxy6methyl2Hpyran2one
3(2(13benzodioxol5yl)23dihydro15benzothiazepin4yl)4hydroxy6methylpyran2one
3(2(13BENZODIOXOL5YL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
3(2(BENZO(D)(13)DIOXOL5YL)23DIHYDROBENZO(B)(14)THIAZEPIN4YL)4HYDROXY6METHYL2HPYRAN2ONE
374704548
InChI=1SC22H17NO5Sc112816(24)21(22(25)2812)151020(2919532414(19)2315)13671718(913)27112617h292024H1011H21H3
MFCD00542842
ZINC000005441819
ZINC000005796929
ZINC00754231
Check stock
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Check stock on Vitas-MAvailable files
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