Vitas-M small molecule compound
methyl (2Z)-2-(2-chloro-6-fluorobenzylidene)-5-(4-chlorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK534418
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)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 C22H15Cl2FN2O3S MW 477.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15Cl2FN2O3S/c1-11-18(21(29)30-2)19(12-6-8-13(23)9-7-12)27-20(28)17(31-22(27)26-11)10-14-15(24)4-3-5-16(14)25/h3-10,19H,1-2H3/b17-10-InChIKey
PXCLCCYYGAXHJS-YVLHZVERSA-NSynonyms
373372-88-4(Z)methyl2(2chloro6fluorobenzylidene)5(4chlorophenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
373372884
CC1=C(C(N2C(=O)C(=CC3=C(C=CC=C3Cl)F)SC2=N1)C4=CC=C(C=C4)Cl)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1c(F)cccc1Cl)s2
InChI=1SC22H15Cl2FN2O3Sc11118(21(29)302)19(126813(23)9712)2720(28)17(3122(27)2611)101415(24)43516(14)25h31019H12H3b1710
METHYL(2Z)2((2CHLORO6FLUOROPHENYL)METHYLIDENE)5(4CHLOROPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2Z)2(2chloro6fluorobenzylidene)5(4chlorophenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD01946168
ZINC000002279761
ZINC000002279763
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