Vitas-M small molecule compound
ethyl (2E)-5-(4-chlorophenyl)-2-{3-[(2,3-dimethylphenoxy)methyl]-4-methoxybenzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL176453
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C\c1ccc(c(c1)COc1cccc(c1C)C)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 C33H31ClN2O5S MW 603.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31ClN2O5S/c1-6-40-32(38)29-21(4)35-33-36(30(29)23-11-13-25(34)14-12-23)31(37)28(42-33)17-22-10-15-27(39-5)24(16-22)18-41-26-9-7-8-19(2)20(26)3/h7-17,30H,6,18H2,1-5H3/b28-17+InChIKey
VUBIJHHRYRANFB-OGLMXYFKSA-NSynonyms
769124-34-7769124347
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(c(c1)COc1cccc(c1C)C)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=CC(=C(C=C4)OC)COC5=CC=CC(=C5C)C)S2)C
ethyl(2E)5(4chlorophenyl)2((3((23dimethylphenoxy)methyl)4methoxyphenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4chlorophenyl)2(3((23dimethylphenoxy)methyl)4methoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC33H31ClN2O5Sc164032(38)2921(4)353336(30(29)23111325(34)141223)31(37)28(4233)1722101527(395)24(1622)18412697819(2)20(26)3h71730H618H215H3b2817+
MFCD04048809
ZINC000102441990
ZINC000102441994
Check stock
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Check stock on Vitas-MAvailable files
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