Vitas-M small molecule compound
methyl (2Z)-2-[2-(acetyloxy)-5-bromobenzylidene]-5-(2-chlorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK701524
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)/c(=C/c1cc(Br)ccc1OC(=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 C24H18BrClN2O5S MW 561.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18BrClN2O5S/c1-12-20(23(31)32-3)21(16-6-4-5-7-17(16)26)28-22(30)19(34-24(28)27-12)11-14-10-15(25)8-9-18(14)33-13(2)29/h4-11,21H,1-3H3/b19-11-InChIKey
MWGMOGQWJSIOBB-ODLFYWEKSA-NSynonyms
CC1=C(C(N2C(=O)C(=CC3=C(C=CC(=C3)Br)OC(=O)C)SC2=N1)C4=CC=CC=C4Cl)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)c(=Cc1cc(Br)ccc1OC(=O)C)s2
InChI=1SC24H18BrClN2O5Sc11220(23(31)323)21(16645717(16)26)2822(30)19(3424(28)2712)11141015(25)8918(14)3313(2)29h41121H13H3b1911
METHYL(2Z)2((2ACETYLOXY5BROMOPHENYL)METHYLIDENE)5(2CHLOROPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2Z)2(2(acetyloxy)5bromobenzylidene)5(2chlorophenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD01163000
ZINC000002688288
ZINC000002688292
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