Vitas-M small molecule compound
ethyl 4-[3-(4-fluorophenyl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
Catalog ID
STL347564
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)ON=C2c1ccc(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 C20H15FN2O5 MW 382.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN2O5/c1-2-27-20(26)12-5-9-14(10-6-12)23-18(24)15-16(22-28-17(15)19(23)25)11-3-7-13(21)8-4-11/h3-10,15,17H,2H2,1H3InChIKey
SCJUYRNNRXKUMA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)ON=C3C4=CC=C(C=C4)F
CCOC(=O)c1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)ON=C2c1ccc(cc1)F
ethyl4((3aR6aS)3(4fluorophenyl)46dioxo66adihydro3aHpyrrolo(34d)isoxazol5(4H)yl)benzoate
ethyl4(3(4fluorophenyl)46dioxo3a466atetrahydro5Hpyrrolo(34d)(12)oxazol5yl)benzoate
ETHYL4(3(4FLUOROPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34D)(12)OXAZOL5YL)BENZOATE
InChI=1SC20H15FN2O5c122720(26)125914(10612)2318(24)1516(222817(15)19(23)25)113713(21)8411h3101517H2H21H3
MFCD28032267
ZINC000101194443
ZINC000101360712
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