Vitas-M small molecule compound
(5Z)-5-(2,4-dimethoxy-5-nitrobenzylidene)-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK176599
SMILES COc1cc(OC)c(cc1/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)C)[N+](=O)[O-]
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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 C20H17N3O7 MW 411.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O7/c1-11-5-4-6-13(7-11)22-19(25)14(18(24)21-20(22)26)8-12-9-15(23(27)28)17(30-3)10-16(12)29-2/h4-10H,1-3H3,(H,21,24,26)/b14-8-InChIKey
JZFVZEMOBFNPQU-ZSOIEALJSA-NSynonyms
(5Z)5((24DIMETHOXY5NITROPHENYL)METHYLIDENE)1(3METHYLPHENYL)13DIAZINANE246TRIONE
(5Z)5(24DIMETHOXY5NITROBENZYLIDENE)1(3METHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC(=C(C=C3OC)OC)(N+)(=O)(O))C(=O)NC2=O
COc1cc(OC)c(cc1C=C1C(=O)NC(=O)N(C1=O)c1cccc(c1)C)(N+)(=O)(O)
InChI=1SC20H17N3O7c11154613(711)2219(25)14(18(24)2120(22)26)812915(23(27)28)17(303)1016(12)292h410H13H3(H212426)b148
MFCD02213564
ZINC000004704504
ZINC04704504
ZINC4704504
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