Vitas-M small molecule compound
(5E)-1-benzyl-2,6-dioxo-5-{1-[(pyridinium-3-ylmethyl)amino]ethylidene}-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STL049751
SMILES O=C1N=C([O-])/C(=C(\NCc2ccc[nH+]c2)/C)/C(=O)N1Cc1ccccc1
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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 C19H18N4O3 MW 350.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O3/c1-13(21-11-15-8-5-9-20-10-15)16-17(24)22-19(26)23(18(16)25)12-14-6-3-2-4-7-14/h2-10,21H,11-12H2,1H3,(H,22,24,26)/b16-13+InChIKey
ALYINDZZKMQHJP-DTQAZKPQSA-NSynonyms
(5E)1benzyl26dioxo5(1((pyridinium3ylmethyl)amino)ethylidene)1256tetrahydropyrimidin4olate
(5E)1BENZYL46DIOXO5(1(PYRIDIN1IUM3YLMETHYLAMINO)ETHYLIDENE)PYRIMIDIN2OLATE
(5E)1BENZYL5(1(PYRIDIN3YLMETHYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
CC(=C1C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2)NCC3=CN=CC=C3
InChI=1SC19H18N4O3c113(211115859201015)1617(24)2219(26)23(18(16)25)12146324714h21021H1112H21H3(H222426)b1613+
MFCD18249287
O=C1N=C((O))C(=C(NCc2ccc(nH+)c2)C)C(=O)N1Cc1ccccc1
ZINC000005624603
ZINC05624603
ZINC5624603
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