Vitas-M small molecule compound
4-hydroxy-3-[2-(4-hydroxy-3-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-6-methyl-2H-pyran-2-one
Catalog ID
STL524767
SMILES COc1cc(ccc1O)C1Sc2ccccc2N=C(C1)c1c(O)cc(oc1=O)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 C22H19NO5S MW 409.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19NO5S/c1-12-9-17(25)21(22(26)28-12)15-11-20(13-7-8-16(24)18(10-13)27-2)29-19-6-4-3-5-14(19)23-15/h3-10,20,24-25H,11H2,1-2H3InChIKey
LEFSSOXXUTTWQA-UHFFFAOYSA-NSynonyms
374703-06-7(3E)3(2(4HYDROXY3METHOXYPHENYL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
135406086
3(2(4HYDROXY3METHOXYPHENYL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
374703067
4hydroxy3(2(4hydroxy3methoxyphenyl)23dihydro15benzothiazepin4yl)6methyl2Hpyran2one
4hydroxy3(2(4hydroxy3methoxyphenyl)23dihydro15benzothiazepin4yl)6methylpyran2one
4HYDROXY3(2(4HYDROXY3METHOXYPHENYL)23DIHYDROBENZO(B)(14)THIAZEPIN4YL)6METHYL2HPYRAN2ONE
InChI=1SC22H19NO5Sc112917(25)21(22(26)2812)151120(137816(24)18(1013)272)2919643514(19)2315h310202425H11H212H3
MFCD00542838
ZINC000005441652
ZINC000005441735
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