Vitas-M small molecule compound
(5E)-2,6-dioxo-1-phenyl-5-{1-[(pyridinium-3-ylmethyl)amino]ethylidene}-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STL057677
SMILES C/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1)[O-])/NCc1ccc[nH+]c1
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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 C18H16N4O3 MW 336.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3/c1-12(20-11-13-6-5-9-19-10-13)15-16(23)21-18(25)22(17(15)24)14-7-3-2-4-8-14/h2-10,20H,11H2,1H3,(H,21,23,25)/b15-12+InChIKey
FCITXVYTNGCCJB-NTCAYCPXSA-NSynonyms
(5E)1PHENYL5(1(PYRIDIN3YLMETHYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
(5E)26dioxo1phenyl5(1((pyridinium3ylmethyl)amino)ethylidene)1256tetrahydropyrimidin4olate
(5E)46dioxo1phenyl5(1(pyridin1ium3ylmethylamino)ethylidene)pyrimidin2olate
1PHENYL5(1((PYRIDIN3YLMETHYL)AMINO)ETH(E)YLIDENE)PYRIMIDINE246TRIONE
CC(=C1C(=NC(=O)N(C1=O)c1ccccc1)(O))NCc1ccc(nH+)c1
CC(=C1C(=O)N=C(N(C1=O)C2=CC=CC=C2)(O))NCC3=C(NH+)=CC=C3
InChI=1SC18H16N4O3c112(201113659191013)1516(23)2118(25)22(17(15)24)147324814h21020H11H21H3(H212325)b1512+
MFCD18249826
ZINC000005816539
ZINC05816539
ZINC5816539
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