Vitas-M small molecule compound
5-({1-[2-(dimethylamino)ethyl]-4,5-dimethyl-3-oxido-1H-imidazol-2-yl}[4-(propan-2-yl)phenyl]methyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL567462
SMILES CN(CCn1c(C)c([n+](c1C(C1C(=O)NC(=O)NC1=O)c1ccc(cc1)C(C)C)[O-])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 C23H31N5O4 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N5O4/c1-13(2)16-7-9-17(10-8-16)18(19-20(29)24-23(31)25-21(19)30)22-27(12-11-26(5)6)14(3)15(4)28(22)32/h7-10,13,18-19H,11-12H2,1-6H3,(H2,24,25,29,30,31)InChIKey
CCMSMXIOXFFQHW-UHFFFAOYSA-NSynonyms
1(2(dimethylamino)ethyl)2((4isopropylphenyl)(246trioxohexahydropyrimidin5yl)methyl)45dimethyl1Himidazole3oxide
128963262
5((1(2(dimethylamino)ethyl)45dimethyl3oxido1Himidazol2yl)(4(propan2yl)phenyl)methyl)pyrimidine246(1H3H5H)trione
5((1(2(dimethylamino)ethyl)45dimethyl3oxidoimidazol3ium2yl)(4propan2ylphenyl)methyl)13diazinane246trione
CN(CCn1c(C)c((n+)(c1C(C1C(=O)NC(=O)NC1=O)c1ccc(cc1)C(C)C)(O))C)C
InChI=1SC23H31N5O4c113(2)167917(10816)18(1920(29)2423(31)2521(19)30)2227(121126(5)6)14(3)15(4)28(22)32h710131819H1112H216H3(H22425293031)
MFCD32652676
ZINC000524734680
ZINC000524734681
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