Vitas-M small molecule compound

triethyl 5,5',5''-benzene-1,3,5-triyltris(3-phenyl-1,2-oxazole-4-carboxylate)

Catalog ID
STL442400
SMILES CCOC(=O)c1c(onc1c1ccccc1)c1cc(cc(c1)c1onc(c1C(=O)OCC)c1ccccc1)c1onc(c1C(=O)OCC)c1ccccc1

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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 C42H33N3O9 MW 723.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H33N3O9/c1-4-49-40(46)31-34(25-16-10-7-11-17-25)43-52-37(31)28-22-29(38-32(41(47)50-5-2)35(44-53-38)26-18-12-8-13-19-26)24-30(23-28)39-33(42(48)51-6-3)36(45-54-39)27-20-14-9-15-21-27/h7-24H,4-6H2,1-3H3
InChIKey
ZXGBHHXNUMYWMJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(ON=C1C2=CC=CC=C2)C3=CC(=CC(=C3)C4=C(C(=NO4)C5=CC=CC=C5)C(=O)OCC)C6=C(C(=NO6)C7=CC=CC=C7)C(=O)OCC
ethyl5(35bis(4ethoxycarbonyl3phenyl12oxazol5yl)phenyl)3phenyl12oxazole4carboxylate
InChI=1SC42H33N3O9c144940(46)3134(2516107111725)435237(31)282229(3832(41(47)5052)35(445338)2618128131926)2430(2328)3933(42(48)5163)36(455439)2720149152127h724H46H213H3
MFCD29709920
triethyl555benzene135triyltris(3phenyl12oxazole4carboxylate)
ZINC000097957330
ZINC97957330

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.