Vitas-M small molecule compound
methyl (2E)-2-[4-(acetyloxy)-3-methoxybenzylidene]-5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK726610
SMILES COc1cc(ccc1OC(=O)C)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC(=O)C)C(=O)OC)C
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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 C27H24N2O8S MW 536.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O8S/c1-14-23(26(33)35-5)24(18-7-9-19(10-8-18)36-15(2)30)29-25(32)22(38-27(29)28-14)13-17-6-11-20(37-16(3)31)21(12-17)34-4/h6-13,24H,1-5H3/b22-13+InChIKey
VOHYSFSHGWMINE-LPYMAVHISA-NSynonyms
(Z)methyl2(4acetoxy3methoxybenzylidene)5(4acetoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=CC(=C(C=C3)OC(=O)C)OC)SC2=N1)C4=CC=C(C=C4)OC(=O)C)C(=O)OC
COc1cc(ccc1OC(=O)C)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC(=O)C)C(=O)OC)C
InChI=1SC27H24N2O8Sc11423(26(33)355)24(187919(10818)3615(2)30)2925(32)22(3827(29)2814)131761120(3716(3)31)21(1217)344h61324H15H3b2213+
methyl(2E)2((4acetyloxy3methoxyphenyl)methylidene)5(4acetyloxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)2(4(acetyloxy)3methoxybenzylidene)5(4(acetyloxy)phenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD01458890
ZINC000097998467
ZINC000097998468
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.