Vitas-M small molecule compound
ethyl (2E)-2-{4-[(furan-2-ylcarbonyl)oxy]benzylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL407000
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1ccc(cc1)OC(=O)c1ccco1)/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 C29H24N2O7S MW 544.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N2O7S/c1-4-36-28(34)24-17(2)30-29-31(25(24)19-9-13-20(35-3)14-10-19)26(32)23(39-29)16-18-7-11-21(12-8-18)38-27(33)22-6-5-15-37-22/h5-16,25H,4H2,1-3H3/b23-16+InChIKey
NDDCWVBCVPCHKE-XQNSMLJCSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(cc1)OC(=O)c1ccco1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(=CC4=CC=C(C=C4)OC(=O)C5=CC=CO5)S2)C
ethyl(2E)2((4(furan2carbonyloxy)phenyl)methylidene)5(4methoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2(4((furan2ylcarbonyl)oxy)benzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC29H24N2O7Sc143628(34)2417(2)302931(25(24)1991320(353)141019)26(32)23(3929)161871121(12818)3827(33)2265153722h51625H4H213H3b2316+
MFCD04083768
ZINC000100303068
ZINC000100303071
Check stock
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Check stock on Vitas-MAvailable files
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