Vitas-M small molecule compound
methyl (2Z)-2-[2-(acetyloxy)-5-bromobenzylidene]-5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK794243
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)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 C26H21BrN2O7S MW 585.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21BrN2O7S/c1-13-22(25(33)34-4)23(16-5-8-19(9-6-16)35-14(2)30)29-24(32)21(37-26(29)28-13)12-17-11-18(27)7-10-20(17)36-15(3)31/h5-12,23H,1-4H3/b21-12-InChIKey
FKLGSTKJUCSIED-MTJSOVHGSA-NSynonyms
(E)methyl2(2acetoxy5bromobenzylidene)5(4acetoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=C(C=CC(=C3)Br)OC(=O)C)SC2=N1)C4=CC=C(C=C4)OC(=O)C)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=Cc1cc(Br)ccc1OC(=O)C)s2
InChI=1SC26H21BrN2O7Sc11322(25(33)344)23(165819(9616)3514(2)30)2924(32)21(3726(29)2813)12171118(27)71020(17)3615(3)31h51223H14H3b2112
METHYL(2Z)2((2ACETYLOXY5BROMOPHENYL)METHYLIDENE)5(4ACETYLOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2Z)2(2(acetyloxy)5bromobenzylidene)5(4(acetyloxy)phenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD13372472
ZINC000000624082
ZINC000000624083
Check stock
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Check stock on Vitas-MAvailable files
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