Vitas-M small molecule compound
ethyl 2-{(3E)-2-(4-ethylphenyl)-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK564770
SMILES CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OC)/O)/C1c1ccc(cc1)CC
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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 C28H28N2O6S MW 520.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O6S/c1-6-17-8-10-18(11-9-17)22-21(23(31)20-13-12-19(35-5)14-15(20)3)24(32)26(33)30(22)28-29-16(4)25(37-28)27(34)36-7-2/h8-14,22,31H,6-7H2,1-5H3/b23-21+InChIKey
RKSPUQDQZVIIQS-XTQSDGFTSA-NSynonyms
487032-36-0487032360
CCC1=CC=C(C=C1)C2C(=C(C3=C(C=C(C=C3)OC)C)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OCC)C
CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(cc2C)OC)O)C1c1ccc(cc1)CC
ethyl2((3E)2(4ethylphenyl)3(hydroxy(4methoxy2methylphenyl)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
ETHYL2(5(4ETHYLPHENYL)3HYDROXY4((4METHOXY2METHYLPHENYL)CARBONYL)2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC28H28N2O6Sc161781018(11917)2221(23(31)20131219(355)1415(20)3)24(32)26(33)30(22)282916(4)25(3728)27(34)3672h8142231H67H215H3b2321+
MFCD03815761
ZINC000102530144
ZINC000102530152
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Check stock on Vitas-MAvailable files
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