Vitas-M small molecule compound
2-({(E)-[4-hydroxy-2,6-dioxo-1-(2-phenylethyl)-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}amino)-N,N,N-trimethylethanaminium
Catalog ID
STL041155
SMILES O=C1N=C(O)/C(=C\NCC[N+](C)(C)C)/C(=O)N1CCc1ccccc1
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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 C18H25N4O3 MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N4O3/c1-22(2,3)12-10-19-13-15-16(23)20-18(25)21(17(15)24)11-9-14-7-5-4-6-8-14/h4-8,13H,9-12H2,1-3H3,(H-,19,20,23,24,25)/p+1InChIKey
VYJVGRMTEYPMJI-UHFFFAOYSA-OSynonyms
2(((E)(4hydroxy26dioxo1(2phenylethyl)16dihydropyrimidin5(2H)ylidene)methyl)amino)NNNtrimethylethanaminium
C(N+)(C)(C)CCNC=C1C(=O)NC(=O)N(C1=O)CCC2=CC=CC=C2
InChI=1SC18H24N4O3c122(23)121019131516(23)2018(25)21(17(15)24)119147546814h4813H912H213H3(H1920232425)p+1
O=C1N=C(O)C(=CNCC(N+)(C)(C)C)C(=O)N1CCc1ccccc1
TRIMETHYL(2(((E)(246TRIOXO1PHENETHYL13DIAZINAN5YLIDENE)METHYL)AMINO)ETHYL)AZANIUM
trimethyl(2((246trioxo1(2phenylethyl)13diazinan5ylidene)methylamino)ethyl)azanium
TRIMETHYL(2((246TRIOXO1PHENETHYL13DIAZINAN5YLIDENE)METHYLAMINO)ETHYL)AZANIUM
ZINC000002429886
ZINC02429886
ZINC2429886
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