Vitas-M small molecule compound
(2E)-6-[(2,5-dimethylbenzyl)oxy]-2-[(1-ethyl-1H-indol-3-yl)methylidene]-7-methyl-1-benzofuran-3(2H)-one
Catalog ID
STK617460
SMILES CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OCc1cc(C)ccc1C
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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 C29H27NO3 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO3/c1-5-30-16-21(23-8-6-7-9-25(23)30)15-27-28(31)24-12-13-26(20(4)29(24)33-27)32-17-22-14-18(2)10-11-19(22)3/h6-16H,5,17H2,1-4H3/b27-15+InChIKey
ATJSAJFWWHJFQK-JFLMPSFJSA-NSynonyms
929399-13-3(2E)6((25dimethylbenzyl)oxy)2((1ethyl1Hindol3yl)methylidene)7methyl1benzofuran3(2H)one
(2E)6((25dimethylphenyl)methoxy)2((1ethylindol3yl)methylidene)7methyl1benzofuran3one
(E)6((25dimethylbenzyl)oxy)2((1ethyl1Hindol3yl)methylene)7methylbenzofuran3(2H)one
929399133
CCN1C=C(C2=CC=CC=C21)C=C3C(=O)C4=C(O3)C(=C(C=C4)OCC5=C(C=CC(=C5)C)C)C
CCn1cc(c2c1cccc2)C=C1Oc2c(C1=O)ccc(c2C)OCc1cc(C)ccc1C
InChI=1SC29H27NO3c15301621(23867925(23)30)152728(31)24121326(20(4)29(24)3327)3217221418(2)101119(22)3h616H517H214H3b2715+
MFCD09795705
ZINC000009423358
ZINC09423358
ZINC9423358
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