Vitas-M small molecule compound
ethyl 5-acetyl-2-({[1-(3-chlorophenyl)-4-oxo-1,4-dihydropyridazin-3-yl]carbonyl}amino)-4-methylthiophene-3-carboxylate
Catalog ID
STK517852
SMILES CCOC(=O)c1c(NC(=O)c2nn(ccc2=O)c2cccc(c2)Cl)sc(c1C)C(=O)C
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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 C21H18ClN3O5S MW 459.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O5S/c1-4-30-21(29)16-11(2)18(12(3)26)31-20(16)23-19(28)17-15(27)8-9-25(24-17)14-7-5-6-13(22)10-14/h5-10H,4H2,1-3H3,(H,23,28)InChIKey
RGHFQOGYAWMLEA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NN(C=CC2=O)C3=CC(=CC=C3)Cl
ethyl5acetyl2(((1(3chlorophenyl)4oxo14dihydropyridazin3yl)carbonyl)amino)4methylthiophene3carboxylate
ethyl5acetyl2((1(3chlorophenyl)4oxopyridazine3carbonyl)amino)4methylthiophene3carboxylate
InChI=1SC21H18ClN3O5Sc143021(29)1611(2)18(12(3)26)3120(16)2319(28)1715(27)8925(2417)1475613(22)1014h510H4H213H3(H2328)
MFCD08550008
ZINC000012111649
ZINC12111649
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