Vitas-M small molecule compound
dimethyl 5-{5-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzene-1,3-dicarboxylate
Catalog ID
STL428613
SMILES COC(=O)c1cc(cc(c1)c1ccc(o1)/C=C\1/SC(=S)N(C1=O)Cc1ccccc1)C(=O)OC
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We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H19NO6S2 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19NO6S2/c1-30-23(28)17-10-16(11-18(12-17)24(29)31-2)20-9-8-19(32-20)13-21-22(27)26(25(33)34-21)14-15-6-4-3-5-7-15/h3-13H,14H2,1-2H3/b21-13+InChIKey
FLNFFSZLJHOYJV-FYJGNVAPSA-NSynonyms
COC(=O)C1=CC(=CC(=C1)C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)C(=O)OC
COC(=O)c1cc(cc(c1)c1ccc(o1)C=C1SC(=S)N(C1=O)Cc1ccccc1)C(=O)OC
dimethyl5(5((E)(3benzyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)furan2yl)benzene13dicarboxylate
dimethyl5(5((E)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)furan2yl)benzene13dicarboxylate
InChI=1SC25H19NO6S2c13023(28)171016(1118(1217)24(29)312)209819(3220)132122(27)26(25(33)3421)14156435715h313H14H212H3b2113+
MFCD04084373
ZINC000009310450
ZINC09310450
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