Vitas-M small molecule compound
ethyl 2-[(3E)-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK562998
SMILES CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OC)/O)/C1c1ccc(cc1)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 C27H26N2O6S MW 506.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O6S/c1-6-35-26(33)24-16(4)28-27(36-24)29-21(17-9-7-14(2)8-10-17)20(23(31)25(29)32)22(30)19-12-11-18(34-5)13-15(19)3/h7-13,21,30H,6H2,1-5H3/b22-20+InChIKey
GBGUHVTZMQIBIE-LSDHQDQOSA-NSynonyms
383899-09-0383899090
CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C3=C(C=C(C=C3)OC)C)O)C(=O)C2=O)C4=CC=C(C=C4)C)C
CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(cc2C)OC)O)C1c1ccc(cc1)C
ethyl2((3E)3(hydroxy(4methoxy2methylphenyl)methylidene)2(4methylphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
InChI=1SC27H26N2O6Sc163526(33)2416(4)2827(3624)2921(179714(2)81017)20(23(31)25(29)32)22(30)19121118(345)1315(19)3h7132130H6H215H3b2220+
MFCD03803791
ZINC000102516951
ZINC000102516959
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