Vitas-M small molecule compound
5-[(1-benzyl-4,5-dimethyl-3-oxido-1H-imidazol-2-yl)(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)methyl]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL568639
SMILES CN1C(=O)N(C)C(=O)C(C1=O)C(c1[n+]([O-])c(c(n1Cc1ccccc1)C)C)c1ccc2c(c1)n(C)c(=O)n2C
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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 C28H30N6O5 MW 530.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N6O5/c1-16-17(2)34(39)24(33(16)15-18-10-8-7-9-11-18)22(23-25(35)31(5)28(38)32(6)26(23)36)19-12-13-20-21(14-19)30(4)27(37)29(20)3/h7-14,22-23H,15H2,1-6H3InChIKey
MXUOXVQQAQTYCF-UHFFFAOYSA-NSynonyms
128962759
1benzyl2((13dimethyl246trioxohexahydropyrimidin5yl)(13dimethyl2oxo23dihydro1Hbenzo(d)imidazol5yl)methyl)45dimethyl1Himidazole3oxide
5((1benzyl45dimethyl3oxido1Himidazol2yl)(13dimethyl2oxo23dihydro1Hbenzimidazol5yl)methyl)13dimethylpyrimidine246(1H3H5H)trione
5((1benzyl45dimethyl3oxidoimidazol3ium2yl)(13dimethyl2oxobenzimidazol5yl)methyl)13dimethyl13diazinane246trione
CN1C(=O)N(C)C(=O)C(C1=O)C(c1(n+)((O))c(c(n1Cc1ccccc1)C)C)c1ccc2c(c1)n(C)c(=O)n2C
InChI=1SC28H30N6O5c11617(2)34(39)24(33(16)1518108791118)22(2325(35)31(5)28(38)32(6)26(23)36)1912132021(1419)30(4)27(37)29(20)3h7142223H15H216H3
MFCD32653706
ZINC000524733031
ZINC000524733032
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