Vitas-M small molecule compound
methyl (2E)-5-[4-(acetyloxy)-3-methoxyphenyl]-7-methyl-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798176
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C\c1cc(OC)c(c(c1)OC)OC)/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 C28H28N2O9S MW 568.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O9S/c1-14-23(27(33)38-7)24(17-8-9-18(39-15(2)31)19(13-17)34-3)30-26(32)22(40-28(30)29-14)12-16-10-20(35-4)25(37-6)21(11-16)36-5/h8-13,24H,1-7H3/b22-12+InChIKey
BIQCAVXMPKQTID-WSDLNYQXSA-NSynonyms
CC1=C(C(N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OC)OC)SC2=N1)C4=CC(=C(C=C4)OC(=O)C)OC)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=Cc1cc(OC)c(c(c1)OC)OC)s2
InChI=1SC28H28N2O9Sc11423(27(33)387)24(178918(3915(2)31)19(1317)343)3026(32)22(4028(30)2914)12161020(354)25(376)21(1116)365h81324H17H3b2212+
methyl(2E)5(4(acetyloxy)3methoxyphenyl)7methyl3oxo2(345trimethoxybenzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4acetyloxy3methoxyphenyl)7methyl3oxo2((345trimethoxyphenyl)methylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD03417579
ZINC000100838369
ZINC000100838371
Check stock
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