Vitas-M small molecule compound
4-hydroxy-3-[7-(2-methoxyphenyl)-2,3,6,7-tetrahydro-1,4-thiazepin-5-yl]-6-methyl-2H-pyran-2-one
Catalog ID
STL525756
SMILES COc1ccccc1C1SCCN=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 C18H19NO4S MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4S/c1-11-9-14(20)17(18(21)23-11)13-10-16(24-8-7-19-13)12-5-3-4-6-15(12)22-2/h3-6,9,16,20H,7-8,10H2,1-2H3InChIKey
WHTGRGOFDHUMEF-UHFFFAOYSA-NSynonyms
(3E)3(7(2METHOXYPHENYL)14THIAZEPAN5YLIDENE)6METHYLPYRAN24DIONE
(3Z)3(7(2METHOXYPHENYL)14THIAZEPAN5YLIDENE)6METHYLPYRAN24DIONE
135406033
3(7(2METHOXYPHENYL)14THIAZEPAN5YLIDENE)6METHYLPYRAN24DIONE
4hydroxy3(7(2methoxyphenyl)2367tetrahydro14thiazepin5yl)6methyl2Hpyran2one
4hydroxy3(7(2methoxyphenyl)2367tetrahydro14thiazepin5yl)6methylpyran2one
InChI=1SC18H19NO4Sc111914(20)17(18(21)2311)131016(24871913)12534615(12)222h3691620H7810H212H3
MFCD00543702
ZINC000005730257
ZINC000005730263
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