Vitas-M small molecule compound
methyl 2-{(3E)-2-(2-ethoxyphenyl)-3-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK846874
SMILES CCOc1ccccc1C1/C(=C(/c2ccc(c(c2)C)OC)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
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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 C27H26N2O7S MW 522.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O7S/c1-6-36-19-10-8-7-9-17(19)21-20(22(30)16-11-12-18(34-4)14(2)13-16)23(31)25(32)29(21)27-28-15(3)24(37-27)26(33)35-5/h7-13,21,30H,6H2,1-5H3/b22-20+InChIKey
UAKDIOZYNLPQNO-LSDHQDQOSA-NSynonyms
459793-93-2459793932
CCOC1=CC=CC=C1C2C(=C(C3=CC(=C(C=C3)OC)C)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OC)C
CCOc1ccccc1C1C(=C(c2ccc(c(c2)C)OC)O)C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
InChI=1SC27H26N2O7Sc1636191087917(19)2120(22(30)16111218(344)14(2)1316)23(31)25(32)29(21)272815(3)24(3727)26(33)355h7132130H6H215H3b2220+
methyl2((3E)2(2ethoxyphenyl)3(hydroxy(4methoxy3methylphenyl)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
MFCD03807193
ZINC000102799632
ZINC000102799636
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