Vitas-M small molecule compound
ethyl (2Z)-5-(3,4-diethoxyphenyl)-2-{3-ethoxy-4-[2-oxo-2-(phenylamino)ethoxy]benzylidene}-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL558376
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc(c(c1)OCC)OCC)c(=O)/c(=C/c1ccc(c(c1)OCC)OCC(=O)Nc1ccccc1)/s2)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 C42H41N3O8S MW 747.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H41N3O8S/c1-5-49-31-22-20-29(25-34(31)51-7-3)39-37(41(48)52-8-4)38(28-15-11-9-12-16-28)44-42-45(39)40(47)35(54-42)24-27-19-21-32(33(23-27)50-6-2)53-26-36(46)43-30-17-13-10-14-18-30/h9-25,39H,5-8,26H2,1-4H3,(H,43,46)/b35-24-InChIKey
GCAZTJFVINTKBG-BGDIREAQSA-NSynonyms
6302732
ethyl(2~(Z))2((4(2anilino2oxoethoxy)3ethoxyphenyl)methylidene)5(34diethoxyphenyl)3oxo7phenyl5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(34diethoxyphenyl)2(3ethoxy4(2oxo2(phenylamino)ethoxy)benzylidene)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC42H41N3O8Sc154931222029(2534(31)5173)3937(41(48)5284)38(2815119121628)444245(39)40(47)35(5442)2427192132(33(2327)5062)532636(46)4330171310141830h92539H5826H214H3(H4346)b3524
MFCD31750798
ZINC000150591310
ZINC000150591314
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