Vitas-M small molecule compound
methyl [(5E)-5-{4-[(3-fluorobenzyl)oxy]-3-methoxybenzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STK152270
SMILES COC(=O)CN1C(=O)S/C(=C/c2ccc(c(c2)OC)OCc2cccc(c2)F)/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 C21H18FNO6S MW 431.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FNO6S/c1-27-17-9-13(6-7-16(17)29-12-14-4-3-5-15(22)8-14)10-18-20(25)23(21(26)30-18)11-19(24)28-2/h3-10H,11-12H2,1-2H3/b18-10+InChIKey
RVBKXDYBCAWGRZ-VCHYOVAHSA-NSynonyms
COC(=O)CN1C(=O)SC(=Cc2ccc(c(c2)OC)OCc2cccc(c2)F)C1=O
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)OC)OCC3=CC(=CC=C3)F
InChI=1SC21H18FNO6Sc12717913(6716(17)29121443515(22)814)101820(25)23(21(26)3018)1119(24)282h310H1112H212H3b1810+
METHYL((5E)5(4((3FLUOROBENZYL)OXY)3METHOXYBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
methyl2((5E)5((4((3fluorophenyl)methoxy)3methoxyphenyl)methylidene)24dioxo13thiazolidin3yl)acetate
MFCD03700070
ZINC000009261137
ZINC09261137
ZINC9261137
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