Vitas-M small molecule compound
8,8-dimethyl-5-(2-nitrophenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Catalog ID
STK955036
SMILES O=C1CC(C)(C)CC2=C1C(c1c(N2)[nH]c(=O)[nH]c1=O)c1ccccc1[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 C19H18N4O5 MW 382.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O5/c1-19(2)7-10-14(12(24)8-19)13(9-5-3-4-6-11(9)23(27)28)15-16(20-10)21-18(26)22-17(15)25/h3-6,13H,7-8H2,1-2H3,(H3,20,21,22,25,26)InChIKey
UPRPJLMMMKUZEC-UHFFFAOYSA-NSynonyms
88dimethyl5(2nitrophenyl)57910tetrahydro1Hpyrimido(45b)quinoline246trione
88dimethyl5(2nitrophenyl)58910tetrahydropyrimido(45b)quinoline246(1H3H7H)trione
CC1(CC2=C(C(C3=C(N2)NC(=O)NC3=O)C4=CC=CC=C4(N+)(=O)(O))C(=O)C1)C
InChI=1SC19H18N4O5c119(2)71014(12(24)819)13(9534611(9)23(27)28)1516(2010)2118(26)2217(15)25h3613H78H212H3(H32021222526)
MFCD02730907
O=C1CC(C)(C)CC2=C1C(c1c(N2)(nH)c(=O)(nH)c1=O)c1ccccc1(N+)(=O)(O)
ZINC000005499591
ZINC000005499632
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