Vitas-M small molecule compound
ethyl [4-(5-carbamoyl-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-4-yl)-2-methoxyphenoxy]acetate
Catalog ID
STL430844
SMILES CCOC(=O)COc1ccc(cc1OC)C1NC(=S)NC(=C1C(=O)N)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 C17H21N3O5S MW 379.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O5S/c1-4-24-13(21)8-25-11-6-5-10(7-12(11)23-3)15-14(16(18)22)9(2)19-17(26)20-15/h5-7,15H,4,8H2,1-3H3,(H2,18,22)(H2,19,20,26)InChIKey
MQWWBCQNWWOZJI-UHFFFAOYSA-NSynonyms
CCOC(=O)COC1=C(C=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)N)OC
ethyl(4(5carbamoyl6methyl2thioxo1234tetrahydropyrimidin4yl)2methoxyphenoxy)acetate
ETHYL2(4(5CARBAMOYL6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDIN4YL)2METHOXYPHENOXY)ACETATE
InChI=1SC17H21N3O5Sc142413(21)825116510(712(11)233)1514(16(18)22)9(2)1917(26)2015h5715H48H213H3(H21822)(H2192026)
MFCD02197502
ZINC000004574716
ZINC000004574717
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