Vitas-M small molecule compound
methyl (2E)-2-[4-(acetyloxy)-3-ethoxybenzylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK533169
SMILES CCOc1cc(ccc1OC(=O)C)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC)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 C28H28N2O8S MW 552.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O8S/c1-7-37-22-12-17(8-10-20(22)38-16(3)31)13-23-26(32)30-25(18-9-11-19(34-4)21(14-18)35-5)24(27(33)36-6)15(2)29-28(30)39-23/h8-14,25H,7H2,1-6H3/b23-13+InChIKey
DFLXHZZXQJTETI-YDZHTSKRSA-NSynonyms
(E)methyl2(4acetoxy3ethoxybenzylidene)5(34dimethoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC1=C(C=CC(=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C4=CC(=C(C=C4)OC)OC)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC)C(=O)OC)C
InChI=1SC28H28N2O8Sc1737221217(81020(22)3816(3)31)132326(32)3025(1891119(344)21(1418)355)24(27(33)366)15(2)2928(30)3923h81425H7H216H3b2313+
METHYL(2E)2((4ACETYLOXY3ETHOXYPHENYL)METHYLIDENE)5(34DIMETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2E)2(4(acetyloxy)3ethoxybenzylidene)5(34dimethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD01954472
ZINC000097966434
ZINC000097966435
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Check stock on Vitas-MAvailable files
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