Vitas-M small molecule compound
4-[(4-{(E)-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-2-methoxyphenoxy)methyl]benzoic acid
Catalog ID
STK562651
SMILES COc1cc(ccc1OCc1ccc(cc1)C(=O)O)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)F)S
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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 C26H19FN2O6S MW 506.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19FN2O6S/c1-34-22-13-16(4-11-21(22)35-14-15-2-5-17(6-3-15)25(32)33)12-20-23(30)28-26(36)29(24(20)31)19-9-7-18(27)8-10-19/h2-13H,14H2,1H3,(H,32,33)(H,28,30,36)/b20-12+InChIKey
TXNHGAPOKDSJCJ-UDWIEESQSA-NSynonyms
330956-53-1330956531
COc1cc(ccc1OCc1ccc(cc1)C(=O)O)C=C1C(=O)N=C(N(C1=O)c1ccc(cc1)F)S
MFCD04080675
ZINC000002262668
Check stock
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Check stock on Vitas-MAvailable files
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