Vitas-M small molecule compound
3-[2-(3,4-dimethoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4-hydroxy-6-methyl-2H-pyran-2-one
Catalog ID
STL524387
SMILES COc1ccc(cc1OC)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 C23H21NO5S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO5S/c1-13-10-17(25)22(23(26)29-13)16-12-21(30-20-7-5-4-6-15(20)24-16)14-8-9-18(27-2)19(11-14)28-3/h4-11,21,25H,12H2,1-3H3InChIKey
CPZTYNWOPDNBNL-UHFFFAOYSA-NSynonyms
374703-40-9(3E)3(2(34DIMETHOXYPHENYL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
135406190
3(2(34dimethoxyphenyl)23dihydro15benzothiazepin4yl)4hydroxy6methyl2Hpyran2one
3(2(34dimethoxyphenyl)23dihydro15benzothiazepin4yl)4hydroxy6methylpyran2one
3(2(34DIMETHOXYPHENYL)23DIHYDROBENZO(B)(14)THIAZEPIN4YL)4HYDROXY6METHYL2HPYRAN2ONE
3(2(34DIMETHOXYPHENYL)35DIHYDRO2H15BENZOTHIAZEPIN4YLIDENE)6METHYLPYRAN24DIONE
374703409
InChI=1SC23H21NO5Sc1131017(25)22(23(26)2913)161221(3020754615(20)2416)148918(272)19(1114)283h4112125H12H213H3
MFCD00542853
ZINC000012657397
ZINC000012657400
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