Vitas-M small molecule compound
4-ethyl 2-methyl 5-({[5-chloro-2-(prop-2-en-1-ylsulfanyl)pyrimidin-4-yl]carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK911343
SMILES C=CCSc1ncc(c(n1)C(=O)Nc1sc(c(c1C(=O)OCC)C)C(=O)OC)Cl
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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 C18H18ClN3O5S2 MW 455.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O5S2/c1-5-7-28-18-20-8-10(19)12(21-18)14(23)22-15-11(16(24)27-6-2)9(3)13(29-15)17(25)26-4/h5,8H,1,6-7H2,2-4H3,(H,22,23)InChIKey
ZVWAECCMMSEMTF-UHFFFAOYSA-NSynonyms
4ethyl2methyl5(((5chloro2(prop2en1ylsulfanyl)pyrimidin4yl)carbonyl)amino)3methylthiophene24dicarboxylate
4Oethyl2Omethyl5((5chloro2prop2enylsulfanylpyrimidine4carbonyl)amino)3methylthiophene24dicarboxylate
CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=NC(=NC=C2Cl)SCC=C
InChI=1SC18H18ClN3O5S2c157281820810(19)12(2118)14(23)221511(16(24)2762)9(3)13(2915)17(25)264h58H167H224H3(H2223)
MFCD07426246
ZINC000008915590
ZINC08915590
ZINC8915590
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