Vitas-M small molecule compound
4-[(2-methoxy-4-{(E)-[3-(1-methoxy-1-oxopropan-2-yl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)methyl]benzoic acid
Catalog ID
STK155008
SMILES COC(=O)C(N1C(=O)S/C(=C/c2ccc(c(c2)OC)OCc2ccc(cc2)C(=O)O)/C1=O)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 C23H21NO8S MW 471.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO8S/c1-13(22(28)31-3)24-20(25)19(33-23(24)29)11-15-6-9-17(18(10-15)30-2)32-12-14-4-7-16(8-5-14)21(26)27/h4-11,13H,12H2,1-3H3,(H,26,27)/b19-11+InChIKey
RDUODJRXPGLMTD-YBFXNURJSA-NSynonyms
4((2METHOXY4((E)(3(1METHOXY1OXOPROPAN2YL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
CC(C(=O)OC)N1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)O)OC)SC1=O
COC(=O)C(N1C(=O)SC(=Cc2ccc(c(c2)OC)OCc2ccc(cc2)C(=O)O)C1=O)C
InChI=1SC23H21NO8Sc113(22(28)313)2420(25)19(3323(24)29)11156917(18(1015)302)3212144716(8514)21(26)27h41113H12H213H3(H2627)b1911+
MFCD06662989
ZINC000009323399
ZINC000009323400
Check stock
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Check stock on Vitas-MAvailable files
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