Vitas-M small molecule compound
3-(2,5-dimethoxyphenyl)-5-(4-fluorophenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Catalog ID
STL094558
SMILES COc1ccc(cc1C1NC(C2C1C(=O)N(C2=O)c1ccc(cc1)F)C(=O)O)OC
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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 C21H19FN2O6 MW 414.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN2O6/c1-29-12-7-8-14(30-2)13(9-12)17-15-16(18(23-17)21(27)28)20(26)24(19(15)25)11-5-3-10(22)4-6-11/h3-9,15-18,23H,1-2H3,(H,27,28)InChIKey
PDDAKTMCYSHELE-UHFFFAOYSA-NSynonyms
1(25dimethoxyphenyl)5(4fluorophenyl)46dioxo233a6atetrahydro1Hpyrrolo(34c)pyrrole3carboxylicacid
3(25dimethoxyphenyl)5(4fluorophenyl)46dioxooctahydropyrrolo(34c)pyrrole1carboxylicacid
COC1=CC(=C(C=C1)OC)C2C3C(C(N2)C(=O)O)C(=O)N(C3=O)C4=CC=C(C=C4)F
InChI=1SC21H19FN2O6c129127814(302)13(912)171516(18(2317)21(27)28)20(26)24(19(15)25)115310(22)4611h39151823H12H3(H2728)
MFCD18788153
ZINC000106549997
ZINC000245246825
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