Vitas-M small molecule compound
methyl (2E)-5-(3,4-dimethoxyphenyl)-2-(4-fluorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK877078
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C\c1ccc(cc1)F)/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 C24H21FN2O5S MW 468.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21FN2O5S/c1-13-20(23(29)32-4)21(15-7-10-17(30-2)18(12-15)31-3)27-22(28)19(33-24(27)26-13)11-14-5-8-16(25)9-6-14/h5-12,21H,1-4H3/b19-11+InChIKey
QVVLEEPXYYBAGA-YBFXNURJSA-NSynonyms
(E)methyl5(34dimethoxyphenyl)2(4fluorobenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)F)SC2=N1)C4=CC(=C(C=C4)OC)OC)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1ccc(cc1)F)s2
InChI=1SC24H21FN2O5Sc11320(23(29)324)21(1571017(302)18(1215)313)2722(28)19(3324(27)2613)11145816(25)9614h51221H14H3b1911+
methyl(2E)5(34dimethoxyphenyl)2((4fluorophenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(34dimethoxyphenyl)2(4fluorobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL5(34DIMETHOXYPHENYL)2((4FLUOROPHENYL)METHYLIDENE)7METHYL3OXO2H3H5HPYRIMIDO(21B)(13)THIAZOLE6CARBOXYLATE
MFCD01954435
ZINC000008765592
ZINC000008765593
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