Vitas-M small molecule compound
ethyl (2Z)-2-[4-(acetyloxy)benzylidene]-5-(2-fluorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK876941
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1F)c(=O)/c(=C/c1ccc(cc1)OC(=O)C)/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 C25H21FN2O5S MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21FN2O5S/c1-4-32-24(31)21-14(2)27-25-28(22(21)18-7-5-6-8-19(18)26)23(30)20(34-25)13-16-9-11-17(12-10-16)33-15(3)29/h5-13,22H,4H2,1-3H3/b20-13-InChIKey
UROPFOQUYNUTPI-MOSHPQCFSA-NSynonyms
(E)ethyl2(4acetoxybenzylidene)5(2fluorophenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
4((6(ETHOXYCARBONYL)5(2FLUOROPHENYL)7METHYL3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDIN2YLIDENE)METHYL)PHENYLACETATE
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1F)c(=O)c(=Cc1ccc(cc1)OC(=O)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3F)C(=O)C(=CC4=CC=C(C=C4)OC(=O)C)S2)C
ETHYL(2Z)2((4ACETYLOXYPHENYL)METHYLIDENE)5(2FLUOROPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(4(acetyloxy)benzylidene)5(2fluorophenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H21FN2O5Sc143224(31)2114(2)272528(22(21)18756819(18)26)23(30)20(3425)131691117(121016)3315(3)29h51322H4H213H3b2013
MFCD03545936
ZINC000000911625
ZINC000000911629
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