Vitas-M small molecule compound
1,3-dimethyl-5-[4-(4-methylpiperazin-1-yl)-3-nitrobenzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK661976
SMILES CN1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C=C1C(=O)N(C)C(=O)N(C1=O)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 C18H21N5O5 MW 387.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N5O5/c1-19-6-8-22(9-7-19)14-5-4-12(11-15(14)23(27)28)10-13-16(24)20(2)18(26)21(3)17(13)25/h4-5,10-11H,6-9H2,1-3H3InChIKey
LEZKPUQCKQHUGY-UHFFFAOYSA-NSynonyms
13DIMETHYL5((4(4METHYLPIPERAZIN1YL)3NITROPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
13dimethyl5(4(4methylpiperazin1yl)3nitrobenzylidene)pyrimidine246(1H3H5H)trione
CN1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C=C1C(=O)N(C)C(=O)N(C1=O)C
CN1CCN(CC1)C2=C(C=C(C=C2)C=C3C(=O)N(C(=O)N(C3=O)C)C)(N+)(=O)(O)
InChI=1SC18H21N5O5c1196822(9719)145412(1115(14)23(27)28)101316(24)20(2)18(26)21(3)17(13)25h451011H69H213H3
MFCD00660005
ZINC000004182393
ZINC4182393
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