Vitas-M small molecule compound
5-{[1-(2-hydroxyethyl)-4,5-dimethyl-3-oxido-1H-imidazol-2-yl](thiophen-3-yl)methyl}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL569110
SMILES OCCn1c(C)c([n+](c1C(C1C(=O)NC(=O)NC1=O)c1ccsc1)[O-])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 C16H18N4O5S MW 378.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O5S/c1-8-9(2)20(25)15(19(8)4-5-21)11(10-3-6-26-7-10)12-13(22)17-16(24)18-14(12)23/h3,6-7,11-12,21H,4-5H2,1-2H3,(H2,17,18,22,23,24)InChIKey
NYKYEPLOAIBDRA-UHFFFAOYSA-NSynonyms
1(2hydroxyethyl)45dimethyl2(thiophen3yl(246trioxohexahydropyrimidin5yl)methyl)1Himidazole3oxide
128962709
5((1(2hydroxyethyl)45dimethyl3oxido1Himidazol2yl)(thiophen3yl)methyl)pyrimidine246(1H3H5H)trione
5((1(2hydroxyethyl)45dimethyl3oxidoimidazol3ium2yl)thiophen3ylmethyl)13diazinane246trione
InChI=1SC16H18N4O5Sc189(2)20(25)15(19(8)4521)11(103626710)1213(22)1716(24)1814(12)23h367111221H45H212H3(H21718222324)
MFCD32654117
OCCn1c(C)c((n+)(c1C(C1C(=O)NC(=O)NC1=O)c1ccsc1)(O))C
ZINC000524732792
ZINC000524732793
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