Vitas-M small molecule compound
ethyl 6-{[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}-4-(1,3-benzodioxol-5-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK777451
SMILES CCOC(=O)C1=C(CSc2nc(N)cc(=O)[nH]2)NC(=O)NC1c1ccc2c(c1)OCO2
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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 C19H19N5O6S MW 445.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O6S/c1-2-28-17(26)15-10(7-31-19-22-13(20)6-14(25)23-19)21-18(27)24-16(15)9-3-4-11-12(5-9)30-8-29-11/h3-6,16H,2,7-8H2,1H3,(H2,21,24,27)(H3,20,22,23,25)InChIKey
SERWYQFBOORPLN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(CSc2nc(N)cc(=O)(nH)2)NC(=O)NC1c1ccc2c(c1)OCO2
CCOC(=O)C1=C(NC(=O)NC1C2=CC3=C(C=C2)OCO3)CSC4=NC(=O)C=C(N4)N
ethyl6(((4amino6oxo16dihydropyrimidin2yl)sulfanyl)methyl)4(13benzodioxol5yl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6((6AMINO4OXO1HPYRIMIDIN2YL)SULFANYLMETHYL)4(13BENZODIOXOL5YL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC19H19N5O6Sc122817(26)1510(731192213(20)614(25)2319)2118(27)2416(15)9341112(59)3082911h3616H278H21H3(H2212427)(H320222325)
MFCD05260572
ZINC000012412590
ZINC000012412592
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