Vitas-M small molecule compound
ethyl (5Z)-5-(3,5-dichloro-4-hydroxybenzylidene)-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL378681
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2cc(Cl)c(c(c2)Cl)O)/C1=O
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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 C20H15Cl2NO4S MW 436.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15Cl2NO4S/c1-2-27-20(26)16-18(25)15(10-11-8-13(21)17(24)14(22)9-11)28-19(16)23-12-6-4-3-5-7-12/h3-10,23-24H,2H2,1H3/b15-10-InChIKey
WHQNNZJURZYMPD-GDNBJRDFSA-NSynonyms
CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2cc(Cl)c(c(c2)Cl)O)C1=O
CCOC(=O)C1=C(SC(=CC2=CC(=C(C(=C2)Cl)O)Cl)C1=O)NC3=CC=CC=C3
ETHYL(5Z)2ANILINO5((35DICHLORO4HYDROXYPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(35dichloro4hydroxybenzylidene)4oxo2(phenylamino)45dihydrothiophene3carboxylate
InChI=1SC20H15Cl2NO4Sc122720(26)1618(25)15(1011813(21)17(24)14(22)911)2819(16)23126435712h3102324H2H21H3b1510
MFCD03711644
ZINC000009295956
ZINC09295956
ZINC9295956
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