Vitas-M small molecule compound
2-methylpropyl 4',6'-dimethoxy-6-methyl-2-thioxo-1,2,3,4-tetrahydro-4,5'-bipyrimidine-5-carboxylate
Catalog ID
STL091260
SMILES COc1ncnc(c1C1NC(=S)NC(=C1C(=O)OCC(C)C)C)OC
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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 C16H22N4O4S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N4O4S/c1-8(2)6-24-15(21)10-9(3)19-16(25)20-12(10)11-13(22-4)17-7-18-14(11)23-5/h7-8,12H,6H2,1-5H3,(H2,19,20,25)InChIKey
XWUHSUNHNSSVPZ-UHFFFAOYSA-NSynonyms
2methylpropyl4(46dimethoxypyrimidin5yl)6methyl2sulfanylidene34dihydro1Hpyrimidine5carboxylate
2methylpropyl46dimethoxy6methyl2thioxo1234tetrahydro45bipyrimidine5carboxylate
CC1=C(C(NC(=S)N1)C2=C(N=CN=C2OC)OC)C(=O)OCC(C)C
InChI=1SC16H22N4O4Sc18(2)62415(21)109(3)1916(25)2012(10)1113(224)1771814(11)235h7812H6H215H3(H2192025)
MFCD18204619
ZINC000057531514
ZINC000057531515
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