Vitas-M small molecule compound
ethyl (5E)-5-(2-chlorobenzylidene)-2-[(4-chlorophenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK158423
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)Cl)S/C(=C/c2ccccc2Cl)/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 C20H15Cl2NO3S MW 420.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15Cl2NO3S/c1-2-26-20(25)17-18(24)16(11-12-5-3-4-6-15(12)22)27-19(17)23-14-9-7-13(21)8-10-14/h3-11,23H,2H2,1H3/b16-11+InChIKey
SHTAMCSSWRLVGW-LFIBNONCSA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)Cl)SC(=Cc2ccccc2Cl)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=CC=C2Cl)C1=O)NC3=CC=C(C=C3)Cl
ETHYL(5E)2(4CHLOROANILINO)5((2CHLOROPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5E)5(2CHLOROBENZYLIDENE)2((4CHLOROPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC20H15Cl2NO3Sc122620(25)1718(24)16(1112534615(12)22)2719(17)23149713(21)81014h31123H2H21H3b1611+
MFCD08679391
ZINC000002905707
ZINC02905707
ZINC2905707
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