Vitas-M small molecule compound
(5Z)-5-{[(1-benzylpiperidinium-4-yl)amino]methylidene}-1-(3,4-dimethylphenyl)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STK570862
SMILES O=C1N=C([O-])/C(=C/NC2CC[NH+](CC2)Cc2ccccc2)/C(=O)N1c1ccc(c(c1)C)C
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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 C25H28N4O3 MW 432.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O3/c1-17-8-9-21(14-18(17)2)29-24(31)22(23(30)27-25(29)32)15-26-20-10-12-28(13-11-20)16-19-6-4-3-5-7-19/h3-9,14-15,20,26H,10-13,16H2,1-2H3,(H,27,30,32)/b22-15-InChIKey
CRTIKYSSKDQUGQ-JCMHNJIXSA-NSynonyms
(5Z)5(((1BENZYLPIPERIDIN1IUM4YL)AMINO)METHYLIDENE)1(34DIMETHYLPHENYL)46DIOXOPYRIMIDIN2OLATE
(5Z)5(((1BENZYLPIPERIDIN4YL)AMINO)METHYLIDENE)1(34DIMETHYLPHENYL)13DIAZINANE246TRIONE
(5Z)5(((1benzylpiperidinium4yl)amino)methylidene)1(34dimethylphenyl)26dioxo1256tetrahydropyrimidin4olate
CC1=C(C=C(C=C1)N2C(=O)C(=CNC3CCN(CC3)CC4=CC=CC=C4)C(=O)NC2=O)C
InChI=1SC25H28N4O3c1178921(1418(17)2)2924(31)22(23(30)2725(29)32)152620101228(131120)16196435719h3914152026H101316H212H3(H273032)b2215
MFCD18245391
O=C1N=C((O))C(=CNC2CC(NH+)(CC2)Cc2ccccc2)C(=O)N1c1ccc(c(c1)C)C
ZINC000020479840
ZINC20479840
Check stock
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