Vitas-M small molecule compound
methyl (2E)-5-(4-chlorophenyl)-2-(2,4-dichlorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK533145
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C\c1ccc(cc1Cl)Cl)/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 C22H15Cl3N2O3S MW 493.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15Cl3N2O3S/c1-11-18(21(29)30-2)19(12-3-6-14(23)7-4-12)27-20(28)17(31-22(27)26-11)9-13-5-8-15(24)10-16(13)25/h3-10,19H,1-2H3/b17-9+InChIKey
QOEZYPAKJBGBJK-RQZCQDPDSA-NSynonyms
358353-55-6(E)methyl5(4chlorophenyl)2(24dichlorobenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
358353556
CC1=C(C(N2C(=O)C(=CC3=C(C=C(C=C3)Cl)Cl)SC2=N1)C4=CC=C(C=C4)Cl)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(cc1Cl)Cl)s2
InChI=1SC22H15Cl3N2O3Sc11118(21(29)302)19(123614(23)7412)2720(28)17(3122(27)2611)9135815(24)1016(13)25h31019H12H3b179+
methyl(2E)5(4chlorophenyl)2((24dichlorophenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4chlorophenyl)2(24dichlorobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD01956967
ZINC000009339690
ZINC000009339691
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