Vitas-M small molecule compound
(5E)-1-butyl-2,6-dioxo-5-(1-{[3-(piperidinium-1-yl)propyl]amino}ethylidene)-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STL051356
SMILES CCCCN1C(=O)N=C(/C(=C(\NCCC[NH+]2CCCCC2)/C)/C1=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 C18H30N4O3 MW 350.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H30N4O3/c1-3-4-13-22-17(24)15(16(23)20-18(22)25)14(2)19-9-8-12-21-10-6-5-7-11-21/h19H,3-13H2,1-2H3,(H,20,23,25)/b15-14+InChIKey
LMBJOHHPLMIKKW-CCEZHUSRSA-NSynonyms
(5E)1butyl26dioxo5(1((3(piperidinium1yl)propyl)amino)ethylidene)1256tetrahydropyrimidin4olate
(5E)1BUTYL46DIOXO5(1(3PIPERIDIN1IUM1YLPROPYLAMINO)ETHYLIDENE)PYRIMIDIN2OLATE
(5E)1BUTYL5(1(3PIPERIDIN1YLPROPYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
CCCCN1C(=O)C(=C(C)NCCC(NH+)2CCCCC2)C(=O)N=C1(O)
CCCCN1C(=O)N=C(C(=C(NCCC(NH+)2CCCCC2)C)C1=O)(O)
InChI=1SC18H30N4O3c134132217(24)15(16(23)2018(22)25)14(2)19981221106571121h19H313H212H3(H202325)b1514+
MFCD18249392
ZINC000020265737
ZINC20265737
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