Vitas-M small molecule compound
3-[2-(5-bromo-2-hydroxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4-hydroxy-6-methyl-2H-pyran-2-one
Catalog ID
STL525188
SMILES Brc1ccc(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 C21H16BrNO4S MW 458.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNO4S/c1-11-8-17(25)20(21(26)27-11)15-10-19(13-9-12(22)6-7-16(13)24)28-18-5-3-2-4-14(18)23-15/h2-9,19,24-25H,10H2,1H3InChIKey
DIKZVSNKAWTORI-UHFFFAOYSA-NSynonyms
374701-88-9(3Z)3(2(5BROMO2HYDROXYPHENYL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
135405997
3(2(5bromo2hydroxyphenyl)23dihydro15benzothiazepin4yl)4hydroxy6methyl2Hpyran2one
3(2(5bromo2hydroxyphenyl)23dihydro15benzothiazepin4yl)4hydroxy6methylpyran2one
3(2(5BROMO2HYDROXYPHENYL)23DIHYDROBENZO(B)(14)THIAZEPIN4YL)4HYDROXY6METHYL2HPYRAN2ONE
3(2(5BROMO2HYDROXYPHENYL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
374701889
InChI=1SC21H16BrNO4Sc111817(25)20(21(26)2711)151019(13912(22)6716(13)24)2818532414(18)2315h29192425H10H21H3
MFCD00542870
ZINC000008740155
ZINC000012656812
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