Vitas-M small molecule compound
ethyl (5Z)-5-[4-(dimethylamino)benzylidene]-2-[(4-methoxyphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK085160
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)OC)S/C(=C\c2ccc(cc2)N(C)C)/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 C23H24N2O4S MW 424.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O4S/c1-5-29-23(27)20-21(26)19(14-15-6-10-17(11-7-15)25(2)3)30-22(20)24-16-8-12-18(28-4)13-9-16/h6-14,24H,5H2,1-4H3/b19-14-InChIKey
MQWNYNJASPKRKO-RGEXLXHISA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)OC)SC(=Cc2ccc(cc2)N(C)C)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=C(C=C2)N(C)C)C1=O)NC3=CC=C(C=C3)OC
ethyl(5Z)5((4(dimethylamino)phenyl)methylidene)2(4methoxyanilino)4oxothiophene3carboxylate
ETHYL(5Z)5((4DIMETHYLAMINOPHENYL)METHYLIDENE)2(4METHOXYANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(4(DIMETHYLAMINO)BENZYLIDENE)2((4METHOXYPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC23H24N2O4Sc152923(27)2021(26)19(141561017(11715)25(2)3)3022(20)241681218(284)13916h61424H5H214H3b1914
MFCD02052772
STK085160
ZINC000006378655
ZINC06378655
ZINC6378655
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.