Vitas-M small molecule compound
ethyl (5Z)-2-[(2,4-dichlorophenyl)amino]-5-(3-hydroxybenzylidene)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK077932
SMILES CCOC(=O)C1=C(S/C(=C\c2cccc(c2)O)/C1=O)Nc1ccc(cc1Cl)Cl
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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)17-18(25)16(9-11-4-3-5-13(24)8-11)28-19(17)23-15-7-6-12(21)10-14(15)22/h3-10,23-24H,2H2,1H3/b16-9-InChIKey
KDKZPOZVPZDJMA-SXGWCWSVSA-NSynonyms
CCOC(=O)C1=C(SC(=CC2=CC(=CC=C2)O)C1=O)NC3=C(C=C(C=C3)Cl)Cl
CCOC(=O)C1=C(SC(=Cc2cccc(c2)O)C1=O)Nc1ccc(cc1Cl)Cl
ETHYL(5Z)2((24DICHLOROPHENYL)AMINO)5(3HYDROXYBENZYLIDENE)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL(5Z)2(24DICHLOROANILINO)5((3HYDROXYPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
InChI=1SC20H15Cl2NO4Sc122720(26)1718(25)16(91143513(24)811)2819(17)23157612(21)1014(15)22h3102324H2H21H3b169
MFCD08679705
STK077932
ZINC000009659931
ZINC09659931
ZINC9659931
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