Vitas-M small molecule compound
5-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(prop-2-en-1-ylsulfanyl)pyrimidine-4-carboxamide
Catalog ID
STK912940
SMILES C=CCSc1ncc(c(n1)C(=O)Nc1nc2c(s1)cc(cc2)OCC)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 C17H15ClN4O2S2 MW 406.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClN4O2S2/c1-3-7-25-16-19-9-11(18)14(21-16)15(23)22-17-20-12-6-5-10(24-4-2)8-13(12)26-17/h3,5-6,8-9H,1,4,7H2,2H3,(H,20,22,23)InChIKey
FGKQKQZTOSVEJR-UHFFFAOYSA-NSynonyms
5chloroN(6ethoxy13benzothiazol2yl)2(prop2en1ylsulfanyl)pyrimidine4carboxamide
5chloroN(6ethoxy13benzothiazol2yl)2prop2enylsulfanylpyrimidine4carboxamide
CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NC(=NC=C3Cl)SCC=C
InChI=1SC17H15ClN4O2S2c137251619911(18)14(2116)15(23)221720126510(2442)813(12)2617h35689H147H22H3(H202223)
MFCD07427902
ZINC000006748100
ZINC06748100
ZINC6748100
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