Vitas-M small molecule compound
ethyl (5Z)-5-(3,5-dichloro-4-hydroxybenzylidene)-2-{[(4-methylphenyl)carbonyl]amino}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL371540
SMILES CCOC(=O)C1=C(S/C(=C\c2cc(Cl)c(c(c2)Cl)O)/C1=O)NC(=O)c1ccc(cc1)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 C22H17Cl2NO5S MW 478.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17Cl2NO5S/c1-3-30-22(29)17-19(27)16(10-12-8-14(23)18(26)15(24)9-12)31-21(17)25-20(28)13-6-4-11(2)5-7-13/h4-10,26H,3H2,1-2H3,(H,25,28)/b16-10-InChIKey
MBAXIOPXFZTSHB-YBEGLDIGSA-NSynonyms
CCOC(=O)C1=C(SC(=CC2=CC(=C(C(=C2)Cl)O)Cl)C1=O)NC(=O)C3=CC=C(C=C3)C
CCOC(=O)C1=C(SC(=Cc2cc(Cl)c(c(c2)Cl)O)C1=O)NC(=O)c1ccc(cc1)C
ETHYL(5Z)5((35DICHLORO4HYDROXYPHENYL)METHYLIDENE)2((4METHYLBENZOYL)AMINO)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(35dichloro4hydroxybenzylidene)2(((4methylphenyl)carbonyl)amino)4oxo45dihydrothiophene3carboxylate
InChI=1SC22H17Cl2NO5Sc133022(29)1719(27)16(1012814(23)18(26)15(24)912)3121(17)2520(28)136411(2)5713h41026H3H212H3(H2528)b1610
MFCD03712439
ZINC000006227894
ZINC06227894
ZINC6227894
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