Vitas-M small molecule compound
4-hydroxy-3-[2-(2-hydroxy-5-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-6-methyl-2H-pyran-2-one
Catalog ID
STL525134
SMILES COc1ccc(c(c1)C1Sc2ccccc2N=C(C1)c1c(O)cc(oc1=O)C)O
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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 C22H19NO5S MW 409.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19NO5S/c1-12-9-18(25)21(22(26)28-12)16-11-20(14-10-13(27-2)7-8-17(14)24)29-19-6-4-3-5-15(19)23-16/h3-10,20,24-25H,11H2,1-2H3InChIKey
RJXNIEKMQFKMNU-UHFFFAOYSA-NSynonyms
374700-09-1135444405
3(2(2HYDROXY5METHOXYPHENYL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
374700091
4hydroxy3(2(2hydroxy5methoxyphenyl)23dihydro15benzothiazepin4yl)6methyl2Hpyran2one
4hydroxy3(2(2hydroxy5methoxyphenyl)23dihydro15benzothiazepin4yl)6methylpyran2one
4HYDROXY3(2(2HYDROXY5METHOXYPHENYL)23DIHYDROBENZO(B)(14)THIAZEPIN4YL)6METHYL2HPYRAN2ONE
InChI=1SC22H19NO5Sc112918(25)21(22(26)2812)161120(141013(272)7817(14)24)2919643515(19)2316h310202425H11H212H3
MFCD00542871
ZINC000005577455
ZINC000006825392
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