Vitas-M small molecule compound
(2Z)-2-(4-chlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 5-ethoxy-2-methyl-1-benzofuran-3-carboxylate
Catalog ID
STK923579
SMILES CCOc1ccc2c(c1)c(C(=O)Oc1ccc3c(c1)O/C(=C\c1ccc(cc1)Cl)/C3=O)c(o2)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 C27H19ClO6 MW 474.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19ClO6/c1-3-31-18-9-11-22-21(13-18)25(15(2)32-22)27(30)33-19-8-10-20-23(14-19)34-24(26(20)29)12-16-4-6-17(28)7-5-16/h4-14H,3H2,1-2H3/b24-12-InChIKey
ACAYXSXMKDUCBK-MSXFZWOLSA-NSynonyms
858767-64-3((2Z)2((4CHLOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)5ETHOXY2METHYL1BENZOFURAN3CARBOXYLATE
(2Z)2(4chlorobenzylidene)3oxo23dihydro1benzofuran6yl5ethoxy2methyl1benzofuran3carboxylate
(Z)2(4chlorobenzylidene)3oxo23dihydrobenzofuran6yl5ethoxy2methylbenzofuran3carboxylate
2((4CHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL5ETHOXY2METHYLBENZO(B)FURAN3CARBOXYLATE
858767643
CCOC1=CC2=C(C=C1)OC(=C2C(=O)OC3=CC4=C(C=C3)C(=O)C(=CC5=CC=C(C=C5)Cl)O4)C
CCOc1ccc2c(c1)c(C(=O)Oc1ccc3c(c1)OC(=Cc1ccc(cc1)Cl)C3=O)c(o2)C
InChI=1SC27H19ClO6c1331189112221(1318)25(15(2)3222)27(30)33198102023(1419)3424(26(20)29)12164617(28)7516h414H3H212H3b2412
MFCD04145155
ZINC000008917860
ZINC08917860
ZINC8917860
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