Vitas-M small molecule compound
1,3-dimethyl-5-[2-(4-nitrobenzyl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK570866
SMILES O=C1N(C)C(=O)C(C(=O)N1C)C1N(Cc2ccc(cc2)[N+](=O)[O-])C(=O)c2c1cccc2
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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 C21H18N4O6 MW 422.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O6/c1-22-19(27)16(20(28)23(2)21(22)29)17-14-5-3-4-6-15(14)18(26)24(17)11-12-7-9-13(10-8-12)25(30)31/h3-10,16-17H,11H2,1-2H3InChIKey
CYACSVTUZYCJOP-UHFFFAOYSA-NSynonyms
714235-27-513DIMETHYL5(2((4NITROPHENYL)METHYL)3OXO1HISOINDOL1YL)13DIAZINANE246TRIONE
13dimethyl5(2(4nitrobenzyl)3oxo23dihydro1Hisoindol1yl)pyrimidine246(1H3H5H)trione
13DIMETHYL5(2(4NITROBENZYL)3OXO23DIHYDRO1HISOINDOL1YL)PYRIMIDINE246TRIONE
13dimethyl5(2(4nitrobenzyl)3oxoisoindolin1yl)pyrimidine246(1H3H5H)trione
714235275
CN1C(=O)C(C(=O)N(C1=O)C)C2C3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H18N4O6c12219(27)16(20(28)23(2)21(22)29)1714534615(14)18(26)24(17)11127913(10812)25(30)31h3101617H11H212H3
MFCD05685992
O=C1N(C)C(=O)C(C(=O)N1C)C1N(Cc2ccc(cc2)(N+)(=O)(O))C(=O)c2c1cccc2
ZINC000008829313
ZINC000008829314
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