Vitas-M small molecule compound
methyl 2-{(3E)-2-(furan-2-yl)-3-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL148461
SMILES COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccco1
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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 C23H20N2O7S MW 468.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O7S/c1-11-10-13(7-8-14(11)30-3)18(26)16-17(15-6-5-9-32-15)25(21(28)19(16)27)23-24-12(2)20(33-23)22(29)31-4/h5-10,17,26H,1-4H3/b18-16+InChIKey
QQOXEKNYSTUYHP-FBMGVBCBSA-NSynonyms
636987-95-6636987956
CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OC)C)C4=CC=CO4)O)OC
COC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(c(c2)C)OC)O)C1c1ccco1
InChI=1SC23H20N2O7Sc1111013(7814(11)303)18(26)1617(156593215)25(21(28)19(16)27)232412(2)20(3323)22(29)314h5101726H14H3b1816+
methyl2((3E)2(furan2yl)3(hydroxy(4methoxy3methylphenyl)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2(5(2FURYL)3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD03811787
ZINC000102928075
ZINC000102928077
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