Vitas-M small molecule compound
prop-2-en-1-yl (2E)-5-[4-(acetyloxy)phenyl]-2-(2-fluorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK793984
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C\c1ccccc1F)/s2
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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 C26H21FN2O5S MW 492.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN2O5S/c1-4-13-33-25(32)22-15(2)28-26-29(23(22)17-9-11-19(12-10-17)34-16(3)30)24(31)21(35-26)14-18-7-5-6-8-20(18)27/h4-12,14,23H,1,13H2,2-3H3/b21-14+InChIKey
WCJAZASVYGUOJY-KGENOOAVSA-NSynonyms
(Z)allyl5(4acetoxyphenyl)2(2fluorobenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
4(2((2FLUOROPHENYL)METHYLENE)7METHYL3OXO6(PROP2ENYLOXYCARBONYL)45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDIN5YL)PHENYLACETATE
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=Cc1ccccc1F)s2
CC1=C(C(N2C(=O)C(=CC3=CC=CC=C3F)SC2=N1)C4=CC=C(C=C4)OC(=O)C)C(=O)OCC=C
InChI=1SC26H21FN2O5Sc14133325(32)2215(2)282629(23(22)1791119(121017)3416(3)30)24(31)21(3526)1418756820(18)27h4121423H113H223H3b2114+
MFCD03650928
prop2en1yl(2E)5(4(acetyloxy)phenyl)2(2fluorobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
prop2enyl(2E)5(4acetyloxyphenyl)2((2fluorophenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000009030791
ZINC000009030794
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Check stock on Vitas-MAvailable files
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