Vitas-M small molecule compound

ethyl (2E)-2-[4-(acetyloxy)-3-ethoxybenzylidene]-5-[4-(acetyloxy)-3-ethoxyphenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK533799
SMILES CCOc1cc(ccc1OC(=O)C)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OCC)OC(=O)C)C(=O)OCC)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 C31H32N2O9S MW 608.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O9S/c1-7-38-24-14-20(10-12-22(24)41-18(5)34)15-26-29(36)33-28(27(30(37)40-9-3)17(4)32-31(33)43-26)21-11-13-23(42-19(6)35)25(16-21)39-8-2/h10-16,28H,7-9H2,1-6H3/b26-15+
InChIKey
PZCQSXKQMZJPEJ-CVKSISIWSA-N
Synonyms

(E)ethyl2(4acetoxy3ethoxybenzylidene)5(4acetoxy3ethoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC1=C(C=CC(=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC(=C(C=C4)OC(=O)C)OCC)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OCC)OC(=O)C)C(=O)OCC)C
ethyl(2E)2(4(acetyloxy)3ethoxybenzylidene)5(4(acetyloxy)3ethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)5(4ACETYLOXY3ETHOXYPHENYL)2((4ACETYLOXY3ETHOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H32N2O9Sc1738241420(101222(24)4118(5)34)152629(36)3328(27(30(37)4093)17(4)3231(33)4326)21111323(4219(6)35)25(1621)3982h101628H79H216H3b2615+
MFCD01958483
ZINC000097966452
ZINC000097966453

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Available files

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