Vitas-M small molecule compound
4-hydroxy-3-[2-(3-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-6-methyl-2H-pyran-2-one
Catalog ID
STL524788
SMILES COc1cccc(c1)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 C22H19NO4S MW 393.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19NO4S/c1-13-10-18(24)21(22(25)27-13)17-12-20(14-6-5-7-15(11-14)26-2)28-19-9-4-3-8-16(19)23-17/h3-11,20,24H,12H2,1-2H3InChIKey
TWLXYYSTPFJSLI-UHFFFAOYSA-NSynonyms
301319-51-7(3E)3(2(3METHOXYPHENYL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
135400425
3(2(3METHOXYPHENYL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
301319517
4hydroxy3(2(3methoxyphenyl)23dihydro15benzothiazepin4yl)6methyl2Hpyran2one
4hydroxy3(2(3methoxyphenyl)23dihydro15benzothiazepin4yl)6methylpyran2one
4HYDROXY3(2(3METHOXYPHENYL)23DIHYDROBENZO(B)(14)THIAZEPIN4YL)6METHYL2HPYRAN2ONE
InChI=1SC22H19NO4Sc1131018(24)21(22(25)2713)171220(1465715(1114)262)2819943816(19)2317h3112024H12H212H3
MFCD00543638
ZINC000005612099
ZINC000005612105
ZINC01230787
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