Vitas-M small molecule compound
ethyl (2Z)-5-[4-(acetyloxy)phenyl]-2-(2-chloro-6-fluorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK833042
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C/c1c(F)cccc1Cl)/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 C25H20ClFN2O5S MW 514.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClFN2O5S/c1-4-33-24(32)21-13(2)28-25-29(22(21)15-8-10-16(11-9-15)34-14(3)30)23(31)20(35-25)12-17-18(26)6-5-7-19(17)27/h5-12,22H,4H2,1-3H3/b20-12-InChIKey
XGXLUHSOZUBQOY-NDENLUEZSA-NSynonyms
(Z)ethyl5(4acetoxyphenyl)2(2chloro6fluorobenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
4(2((2CHLORO6FLUOROPHENYL)METHYLENE)6(ETHOXYCARBONYL)7METHYL3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDIN5YL)PHENYLACETATE
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=Cc1c(F)cccc1Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC(=O)C)C(=O)C(=CC4=C(C=CC=C4Cl)F)S2)C
ethyl(2Z)5(4(acetyloxy)phenyl)2(2chloro6fluorobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ACETYLOXYPHENYL)2((2CHLORO6FLUOROPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(4(ACETYLOXY)PHENYL)2(2CHLORO6FLUOROBENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC25H20ClFN2O5Sc143324(32)2113(2)282529(22(21)1581016(11915)3414(3)30)23(31)20(3525)121718(26)65719(17)27h51222H4H213H3b2012
MFCD01072587
ZINC000001835227
ZINC000001835229
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