Vitas-M small molecule compound
prop-2-en-1-yl 4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK704416
SMILES C=CCOC(=O)C1=C(C)NC(=S)NC1c1ccc(c(c1)OCC)O
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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 C17H20N2O4S MW 348.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4S/c1-4-8-23-16(21)14-10(3)18-17(24)19-15(14)11-6-7-12(20)13(9-11)22-5-2/h4,6-7,9,15,20H,1,5,8H2,2-3H3,(H2,18,19,24)InChIKey
ZEHULFQJBGLOSZ-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C(=C(NC(=S)N2)C)C(=O)OCC=C)O
InChI=1SC17H20N2O4Sc1482316(21)1410(3)1817(24)1915(14)116712(20)13(911)2252h46791520H158H223H3(H2181924)
MFCD04446511
prop2en1yl4(3ethoxy4hydroxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
PROP2ENYL4(3ETHOXY4HYDROXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ZINC000006354933
ZINC000006354934
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