Vitas-M small molecule compound
ethyl (2Z)-2-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-5-(2-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL508304
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)/c(=C/c1cc3OCOc3cc1Cl)/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 C25H21ClN2O6S MW 512.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O6S/c1-4-32-24(30)21-13(2)27-25-28(22(21)15-7-5-6-8-17(15)31-3)23(29)20(35-25)10-14-9-18-19(11-16(14)26)34-12-33-18/h5-11,22H,4,12H2,1-3H3/b20-10-InChIKey
YOMIMWXFNYCXMY-JMIUGGIZSA-NSynonyms
132452471
ethyl(2~(Z))2((6chloro13benzodioxol5yl)methylidene)5(2methoxyphenyl)7methyl3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)2((6chloro13benzodioxol5yl)methylidene)5(2methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H21ClN2O6Sc143224(30)2113(2)272528(22(21)15756817(15)313)23(29)20(3525)101491819(1116(14)26)34123318h51122H412H213H3b2010
MFCD31614409
ZINC000103602446
ZINC000103602449
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