Vitas-M small molecule compound
1-{2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)amino]-2-oxoethyl}-3-phenyl-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Catalog ID
STL047956
SMILES O=C(Cn1cc([n+]2c1CCC2)c1ccccc1)Nc1cc(=O)n(c(=O)n1C)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 C20H22N5O3 MW 380.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3/c1-22-16(11-19(27)23(2)20(22)28)21-17(26)13-24-12-15(14-7-4-3-5-8-14)25-10-6-9-18(24)25/h3-5,7-8,11-12H,6,9-10,13H2,1-2H3/p+1InChIKey
IDBWSLIWROIECZ-UHFFFAOYSA-OSynonyms
1(2((13dimethyl26dioxo1236tetrahydropyrimidin4yl)amino)2oxoethyl)3phenyl1567tetrahydropyrrolo(12a)imidazol4ium
CN1C(=CC(=O)N(C1=O)C)NC(=O)C(N+)2=C3CCCN3C(=C2)C4=CC=CC=C4
InChI=1SC20H21N5O3c12216(1119(27)23(2)20(22)28)2117(26)13241215(147435814)25106918(24)25h35781112H691013H212H3p+1
N(13DIMETHYL26DIOXO(13DIHYDROPYRIMIDIN4YL))2(3PHENYL(1PYRROLINO(21B)IMIDAZOLYL))ACETAMIDE
N(13DIMETHYL26DIOXOPYRIMIDIN4YL)2(3PHENYL67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM1YL)ACETAMIDE
O=C(Cn1cc((n+)2c1CCC2)c1ccccc1)Nc1cc(=O)n(c(=O)n1C)C
ZINC000013779100
ZINC13779100
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