Vitas-M small molecule compound
methyl (2E)-2-(2-fluorobenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL324085
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccccc1)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 C22H17FN2O3S MW 408.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17FN2O3S/c1-13-18(21(27)28-2)19(14-8-4-3-5-9-14)25-20(26)17(29-22(25)24-13)12-15-10-6-7-11-16(15)23/h3-12,19H,1-2H3/b17-12+InChIKey
SBNSEPNDHFZRNE-SFQUDFHCSA-NSynonyms
300377-32-6(E)methyl2(2fluorobenzylidene)7methyl3oxo5phenyl35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
300377326
CC1=C(C(N2C(=O)C(=CC3=CC=CC=C3F)SC2=N1)C4=CC=CC=C4)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccccc1F)s2
InChI=1SC22H17FN2O3Sc11318(21(27)282)19(148435914)2520(26)17(2922(25)2413)121510671116(15)23h31219H12H3b1712+
methyl(2E)2((2fluorophenyl)methylidene)7methyl3oxo5phenyl5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)2(2fluorobenzylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD00722404
ZINC000004795706
ZINC000004795708
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