Vitas-M small molecule compound
1-[3-({[4-hydroxy-6-methyl-5-(3-methylbutyl)pyrimidin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]ethanone
Catalog ID
STL336101
SMILES COc1ccc(cc1CSc1nc(C)c(c(n1)O)CCC(C)C)C(=O)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 C20H26N2O3S MW 374.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O3S/c1-12(2)6-8-17-13(3)21-20(22-19(17)24)26-11-16-10-15(14(4)23)7-9-18(16)25-5/h7,9-10,12H,6,8,11H2,1-5H3,(H,21,22,24)InChIKey
BUFDMJFVKVYJFM-UHFFFAOYSA-NSynonyms
723254-54-41(3(((4hydroxy5isopentyl6methylpyrimidin2yl)thio)methyl)4methoxyphenyl)ethanone
1(3(((4hydroxy6methyl5(3methylbutyl)pyrimidin2yl)sulfanyl)methyl)4methoxyphenyl)ethanone
2((5ACETYL2METHOXYPHENYL)METHYLSULFANYL)6METHYL5(3METHYLBUTYL)1HPYRIMIDIN4ONE
723254544
CC1=C(C(=O)N=C(N1)SCC2=C(C=CC(=C2)C(=O)C)OC)CCC(C)C
InChI=1SC20H26N2O3Sc112(2)681713(3)2120(2219(17)24)2611161015(14(4)23)7918(16)255h791012H6811H215H3(H212224)
MFCD03663243
ZINC000018179689
ZINC18179689
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