Vitas-M small molecule compound
1-(butan-2-yl)-7-methyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179628
SMILES CCC(n1c(S)nc(=O)c2c1nc(C)cc2C(F)(F)F)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 C13H14F3N3OS MW 317.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14F3N3OS/c1-4-7(3)19-10-9(11(20)18-12(19)21)8(13(14,15)16)5-6(2)17-10/h5,7H,4H2,1-3H3,(H,18,20,21)InChIKey
LITCEIIMFZNOCI-UHFFFAOYSA-NSynonyms
1(butan2yl)7methyl2sulfanyl5(trifluoromethyl)pyrido(23d)pyrimidin4(1H)one
1butan2yl7methyl2sulfanylidene5(trifluoromethyl)pyrido(23d)pyrimidin4one
CCC(C)N1C2=C(C(=CC(=N2)C)C(F)(F)F)C(=O)NC1=S
InChI=1SC13H14F3N3OSc147(3)19109(11(20)1812(19)21)8(13(1415)16)56(2)1710h57H4H213H3(H182021)
MFCD09472573
ZINC000020615670
ZINC000020615671
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