Vitas-M small molecule compound
3-(4-fluoro-3-methylphenyl)-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL031463
SMILES CC1CCN(CC1)C(=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/c1-13-5-8-24(9-6-13)18(26)12-29-21-23-17-7-10-28-19(17)20(27)25(21)15-3-4-16(22)14(2)11-15/h3-4,7,10-11,13H,5-6,8-9,12H2,1-2H3InChIKey
KZNZTINZOJHGRS-UHFFFAOYSA-NSynonyms
3(4fluoro3methylphenyl)2((2(4methylpiperidin1yl)2oxoethyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(4fluoro3methylphenyl)2(2(4methylpiperidin1yl)2oxoethyl)sulfanylthieno(32d)pyrimidin4one
CC1CCN(CC1)C(=O)CSC2=NC3=C(C(=O)N2C4=CC(=C(C=C4)F)C)SC=C3
InChI=1SC21H22FN3O2S2c1135824(9613)18(26)12292123177102819(17)20(27)25(21)153416(22)14(2)1115h347101113H568912H212H3
MFCD18191508
ZINC000057428626
ZINC57428626
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