Vitas-M small molecule compound
3-(4-fluoro-3-methylphenyl)-2-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL031471
SMILES CC1CCCCN1C(=O)CSc1nc2ccsc2c(=O)n1c1ccc(c(c1)C)F
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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 C21H22FN3O2S2 MW 431.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN3O2S2/c1-13-11-15(6-7-16(13)22)25-20(27)19-17(8-10-28-19)23-21(25)29-12-18(26)24-9-4-3-5-14(24)2/h6-8,10-11,14H,3-5,9,12H2,1-2H3InChIKey
LCVKPJWUTKPFJA-UHFFFAOYSA-NSynonyms
3(4fluoro3methylphenyl)2((2(2methylpiperidin1yl)2oxoethyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(4fluoro3methylphenyl)2(2(2methylpiperidin1yl)2oxoethyl)sulfanylthieno(32d)pyrimidin4one
CC1CCCCN1C(=O)CSC2=NC3=C(C(=O)N2C4=CC(=C(C=C4)F)C)SC=C3
InChI=1SC21H22FN3O2S2c1131115(6716(13)22)2520(27)1917(8102819)2321(25)291218(26)24943514(24)2h68101114H35912H212H3
MFCD18191516
ZINC000057428648
ZINC000057428650
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