Vitas-M small molecule compound
ethyl (2E)-5-[4-(acetyloxy)-3-methoxyphenyl]-7-methyl-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK799132
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C\c1ccc(o1)C)/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 C25H24N2O7S MW 496.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O7S/c1-6-32-24(30)21-14(3)26-25-27(23(29)20(35-25)12-17-9-7-13(2)33-17)22(21)16-8-10-18(34-15(4)28)19(11-16)31-5/h7-12,22H,6H2,1-5H3/b20-12+InChIKey
NAVJOWKAVFGIPM-UDWIEESQSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=Cc1ccc(o1)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)C(=CC4=CC=C(O4)C)S2)C
ethyl(2E)5(4(acetyloxy)3methoxyphenyl)7methyl2((5methylfuran2yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4acetyloxy3methoxyphenyl)7methyl2((5methylfuran2yl)methylidene)3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H24N2O7Sc163224(30)2114(3)262527(23(29)20(3525)12179713(2)3317)22(21)1681018(3415(4)28)19(1116)315h71222H6H215H3b2012+
MFCD03462301
ZINC000016700730
ZINC000016700733
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