Vitas-M small molecule compound
1,3-dimethyl-5-{3-[2-(4-nitrophenoxy)ethoxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK020389
SMILES O=C1N(C)C(=O)C(=Cc2cccc(c2)OCCOc2ccc(cc2)[N+](=O)[O-])C(=O)N1C
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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 C21H19N3O7 MW 425.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O7/c1-22-19(25)18(20(26)23(2)21(22)27)13-14-4-3-5-17(12-14)31-11-10-30-16-8-6-15(7-9-16)24(28)29/h3-9,12-13H,10-11H2,1-2H3InChIKey
QJEJLYNTRKALBT-UHFFFAOYSA-NSynonyms
13DIMETHYL5((3(2(4NITROPHENOXY)ETHOXY)PHENYL)METHYLIDENE)13DIAZINANE246TRIONE
13DIMETHYL5(3(2(4NITROPHENOXY)ETHOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CN1C(=O)C(=CC2=CC(=CC=C2)OCCOC3=CC=C(C=C3)(N+)(=O)(O))C(=O)N(C1=O)C
InChI=1SC21H19N3O7c12219(25)18(20(26)23(2)21(22)27)131443517(1214)31111030168615(7916)24(28)29h391213H1011H212H3
MFCD01873423
O=C1N(C)C(=O)C(=Cc2cccc(c2)OCCOc2ccc(cc2)(N+)(=O)(O))C(=O)N1C
STK020389
ZINC000002987122
ZINC02987122
ZINC2987122
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