Vitas-M small molecule compound
ethyl (2E)-2-({[3-(4-fluoro-2-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}imino)-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STL157794
SMILES CCOC(=O)c1s/c(=N/C(=O)Cn2nc(ccc2=O)c2ccc(cc2OC)F)/[nH]c1C
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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 C20H19FN4O5S MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19FN4O5S/c1-4-30-19(28)18-11(2)22-20(31-18)23-16(26)10-25-17(27)8-7-14(24-25)13-6-5-12(21)9-15(13)29-3/h5-9H,4,10H2,1-3H3,(H,22,23,26)InChIKey
LVYYCXVOUVNXPI-UHFFFAOYSA-NSynonyms
1246054-32-91246054329
CCOC(=O)C1=C(N=C(S1)NC(=O)CN2C(=O)C=CC(=N2)C3=C(C=C(C=C3)F)OC)C
CCOC(=O)c1sc(=NC(=O)Cn2nc(ccc2=O)c2ccc(cc2OC)F)(nH)c1C
ethyl(2E)2(((3(4fluoro2methoxyphenyl)6oxopyridazin1(6H)yl)acetyl)imino)4methyl23dihydro13thiazole5carboxylate
ethyl2((2(3(4fluoro2methoxyphenyl)6oxopyridazin1yl)acetyl)amino)4methyl13thiazole5carboxylate
InChI=1SC20H19FN4O5Sc143019(28)1811(2)2220(3118)2316(26)102517(27)8714(2425)136512(21)915(13)293h59H410H213H3(H222326)
MFCD20758128
ZINC000049547710
ZINC49547710
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