Vitas-M small molecule compound
ethyl 3-{5-[(E)-{3-[4-(dimethylamino)phenyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]furan-2-yl}benzoate
Catalog ID
STL419045
SMILES CCOC(=O)c1cccc(c1)c1ccc(o1)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)N(C)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 C25H22N2O4S2 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O4S2/c1-4-30-24(29)17-7-5-6-16(14-17)21-13-12-20(31-21)15-22-23(28)27(25(32)33-22)19-10-8-18(9-11-19)26(2)3/h5-15H,4H2,1-3H3/b22-15+InChIKey
LYTGZZJXZYKUMI-PXLXIMEGSA-NSynonyms
CCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)C4=CC=C(C=C4)N(C)C
CCOC(=O)c1cccc(c1)c1ccc(o1)C=C1SC(=S)N(C1=O)c1ccc(cc1)N(C)C
ethyl3(5((E)(3(4(dimethylamino)phenyl)4oxo2sulfanylidene13thiazolidin5ylidene)methyl)furan2yl)benzoate
ethyl3(5((E)(3(4(dimethylamino)phenyl)4oxo2thioxo13thiazolidin5ylidene)methyl)furan2yl)benzoate
InChI=1SC25H22N2O4S2c143024(29)1775616(1417)21131220(3121)152223(28)27(25(32)3322)1910818(91119)26(2)3h515H4H213H3b2215+
MFCD04084350
ZINC000009310428
ZINC09310428
ZINC9310428
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