Vitas-M small molecule compound

2-methylpropyl (2Z)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-[4-(benzyloxy)-3-methoxybenzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK799121
SMILES COc1cc(ccc1OCc1ccccc1)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OCC(C)C)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 C36H36N2O8S MW 656.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H36N2O8S/c1-21(2)19-45-35(41)32-22(3)37-36-38(33(32)26-13-15-28(46-23(4)39)30(18-26)43-6)34(40)31(47-36)17-25-12-14-27(29(16-25)42-5)44-20-24-10-8-7-9-11-24/h7-18,21,33H,19-20H2,1-6H3/b31-17-
InChIKey
IAOWYHIXMTUURZ-LJUMEUDFSA-N
Synonyms

2methylpropyl(2Z)5(4(acetyloxy)3methoxyphenyl)2(4(benzyloxy)3methoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
2METHYLPROPYL(2Z)5(4ACETYLOXY3METHOXYPHENYL)2((3METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
CC1=C(C(N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)SC2=N1)C5=CC(=C(C=C5)OC(=O)C)OC)C(=O)OCC(C)C
COc1cc(ccc1OCc1ccccc1)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OCC(C)C)C
InChI=1SC36H36N2O8Sc121(2)194535(41)3222(3)373638(33(32)26131528(4623(4)39)30(1826)436)34(40)31(4736)1725121427(29(1625)425)442024108791124h7182133H1920H216H3b3117
MFCD03462291
ZINC000097946261
ZINC000097946262

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Available files

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