Vitas-M small molecule compound
N-(2-bromo-4,5-dimethylphenyl)-2-(2-methoxy-4-{(E)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetamide
Catalog ID
STL428655
SMILES C=CCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OCC(=O)Nc2cc(C)c(cc2Br)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 C24H23BrN2O4S2 MW 547.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23BrN2O4S2/c1-5-8-27-23(29)21(33-24(27)32)12-16-6-7-19(20(11-16)30-4)31-13-22(28)26-18-10-15(3)14(2)9-17(18)25/h5-7,9-12H,1,8,13H2,2-4H3,(H,26,28)/b21-12+InChIKey
PLTYSZXPTZOCAB-CIAFOILYSA-NSynonyms
C=CCN1C(=S)SC(=Cc2ccc(c(c2)OC)OCC(=O)Nc2cc(C)c(cc2Br)C)C1=O
CC1=CC(=C(C=C1C)Br)NC(=O)COC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC=C)OC
InChI=1SC24H23BrN2O4S2c1582723(29)21(3324(27)32)12166719(20(1116)304)311322(28)26181015(3)14(2)917(18)25h57912H1813H224H3(H2628)b2112+
MFCD04084429
N(2bromo45dimethylphenyl)2(2methoxy4((E)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)phenoxy)acetamide
N(2bromo45dimethylphenyl)2(2methoxy4((E)(4oxo3prop2enyl2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)acetamide
ZINC000101095235
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