Vitas-M small molecule compound
2-ethoxy-4-{(E)-[2-(4-fluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-chlorobenzoate
Catalog ID
STL427128
SMILES CCOc1cc(ccc1OC(=O)c1ccc(cc1)Cl)/C=C\1/N=C(OC1=O)c1ccc(cc1)F
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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 C25H17ClFNO5 MW 465.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClFNO5/c1-2-31-22-14-15(3-12-21(22)32-24(29)17-4-8-18(26)9-5-17)13-20-25(30)33-23(28-20)16-6-10-19(27)11-7-16/h3-14H,2H2,1H3/b20-13+InChIKey
QTWFSVNVQBODPT-DEDYPNTBSA-NSynonyms
(2ETHOXY4((E)(2(4FLUOROPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)PHENYL)4CHLOROBENZOATE
2ethoxy4((E)(2(4fluorophenyl)5oxo13oxazol4(5H)ylidene)methyl)phenyl4chlorobenzoate
CCOC1=C(C=CC(=C1)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)F)OC(=O)C4=CC=C(C=C4)Cl
CCOc1cc(ccc1OC(=O)c1ccc(cc1)Cl)C=C1N=C(OC1=O)c1ccc(cc1)F
InChI=1SC25H17ClFNO5c1231221415(31221(22)3224(29)174818(26)9517)132025(30)3323(2820)1661019(27)11716h314H2H21H3b2013+
MFCD30710476
ZINC000003000643
ZINC3000643
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