Vitas-M small molecule compound
3-[7-(3,4-dimethoxyphenyl)-2,3,6,7-tetrahydro-1,4-thiazepin-5-yl]-4-hydroxy-6-methyl-2H-pyran-2-one
Catalog ID
STL525918
SMILES COc1cc(ccc1OC)C1SCCN=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 C19H21NO5S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO5S/c1-11-8-14(21)18(19(22)25-11)13-10-17(26-7-6-20-13)12-4-5-15(23-2)16(9-12)24-3/h4-5,8-9,17,21H,6-7,10H2,1-3H3InChIKey
QSEUXIIIAQJIFL-UHFFFAOYSA-NSynonyms
(3E)3(7(34DIMETHOXYPHENYL)14THIAZEPAN5YLIDENE)6METHYLPYRAN24DIONE
135538812
3(7(34DIMETHOXYPHENYL)14THIAZEPAN5YLIDENE)6METHYLPYRAN24DIONE
3(7(34dimethoxyphenyl)2367tetrahydro14thiazepin5yl)4hydroxy6methyl2Hpyran2one
3(7(34dimethoxyphenyl)2367tetrahydro14thiazepin5yl)4hydroxy6methylpyran2one
331852563
InChI=1SC19H21NO5Sc111814(21)18(19(22)2511)131017(26762013)124515(232)16(912)243h45891721H6710H213H3
MFCD00542881
ZINC000005441459
ZINC000005441561
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