Vitas-M small molecule compound
methyl 4-{(3E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[hydroxy(5-methylfuran-2-yl)methylidene]-4,5-dioxopyrrolidin-2-yl}benzoate
Catalog ID
STL148356
SMILES CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(=O)OC)/C(=C(/c2ccc(o2)C)\O)/C(=O)C1=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 C27H22N2O7S MW 518.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O7S/c1-4-35-17-10-11-18-20(13-17)37-27(28-18)29-22(15-6-8-16(9-7-15)26(33)34-3)21(24(31)25(29)32)23(30)19-12-5-14(2)36-19/h5-13,22,30H,4H2,1-3H3/b23-21+InChIKey
BVNPYQFXPORLCJ-XTQSDGFTSA-NSynonyms
CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(=O)OC)C(=C(c2ccc(o2)C)O)C(=O)C1=O
methyl4((3E)1(6ethoxy13benzothiazol2yl)3(hydroxy(5methylfuran2yl)methylidene)45dioxopyrrolidin2yl)benzoate
MFCD03799057
ZINC000102927904
ZINC000102927907
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