Vitas-M small molecule compound
methyl 2-[3-(2-chlorophenyl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
Catalog ID
STK626018
SMILES COC(=O)c1ccccc1N1C(=O)C2C(C1=O)C(=NO2)c1ccccc1Cl
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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 C19H13ClN2O5 MW 384.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClN2O5/c1-26-19(25)11-7-3-5-9-13(11)22-17(23)14-15(21-27-16(14)18(22)24)10-6-2-4-8-12(10)20/h2-9,14,16H,1H3InChIKey
RJJXGHSBHAABBR-UHFFFAOYSA-NSynonyms
951927-00-7951927007
COC(=O)C1=CC=CC=C1N2C(=O)C3C(C2=O)ON=C3C4=CC=CC=C4Cl
InChI=1SC19H13ClN2O5c12619(25)11735913(11)2217(23)1415(212716(14)18(22)24)10624812(10)20h291416H1H3
methyl2(3(2chlorophenyl)46dioxo3a466atetrahydro5Hpyrrolo(34d)(12)oxazol5yl)benzoate
methyl2(3(2chlorophenyl)46dioxo3a6adihydropyrrolo(34d)(12)oxazol5yl)benzoate
methyl2(3(2chlorophenyl)46dioxo66adihydro3aHpyrrolo(34d)isoxazol5(4H)yl)benzoate
MFCD09850429
ZINC000101493667
ZINC000101493674
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