Vitas-M small molecule compound
methyl 2-[3-(4-methylphenyl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
Catalog ID
STK620184
SMILES COC(=O)c1ccccc1N1C(=O)C2C(C1=O)C(=NO2)c1ccc(cc1)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 C20H16N2O5 MW 364.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O5/c1-11-7-9-12(10-8-11)16-15-17(27-21-16)19(24)22(18(15)23)14-6-4-3-5-13(14)20(25)26-2/h3-10,15,17H,1-2H3InChIKey
YIDOIDLIGUYRFT-UHFFFAOYSA-NSynonyms
951983-27-0951983270
CC1=CC=C(C=C1)C2=NOC3C2C(=O)N(C3=O)C4=CC=CC=C4C(=O)OC
InChI=1SC20H16N2O5c1117912(10811)161517(272116)19(24)22(18(15)23)14643513(14)20(25)262h3101517H12H3
methyl2(3(4methylphenyl)46dioxo3a466atetrahydro5Hpyrrolo(34d)(12)oxazol5yl)benzoate
methyl2(3(4methylphenyl)46dioxo3a6adihydropyrrolo(34d)(12)oxazol5yl)benzoate
methyl2(46dioxo3(ptolyl)66adihydro3aHpyrrolo(34d)isoxazol5(4H)yl)benzoate
MFCD09853501
ZINC000013692546
ZINC000101500193
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