Vitas-M small molecule compound
5-chloro-N-(4-ethoxyphenyl)-2-(prop-2-en-1-ylsulfanyl)pyrimidine-4-carboxamide
Catalog ID
STK911345
SMILES C=CCSc1ncc(c(n1)C(=O)Nc1ccc(cc1)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 C16H16ClN3O2S MW 349.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O2S/c1-3-9-23-16-18-10-13(17)14(20-16)15(21)19-11-5-7-12(8-6-11)22-4-2/h3,5-8,10H,1,4,9H2,2H3,(H,19,21)InChIKey
XOMKFPGOJZNJFE-UHFFFAOYSA-NSynonyms
873082-31-65chloroN(4ethoxyphenyl)2(prop2en1ylsulfanyl)pyrimidine4carboxamide
5chloroN(4ethoxyphenyl)2prop2enylsulfanylpyrimidine4carboxamide
873082316
CCOC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)SCC=C
InChI=1SC16H16ClN3O2Sc1392316181013(17)14(2016)15(21)19115712(8611)2242h35810H149H22H3(H1921)
MFCD07426248
ZINC000006748025
ZINC06748025
ZINC6748025
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