Vitas-M small molecule compound

3-(3,5-difluorophenyl)-2-{[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one

Catalog ID
STL076731
SMILES CC1CC(C)CN(C1)C(=O)CSc1nc2ccsc2c(=O)n1c1cc(F)cc(c1)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 C21H21F2N3O2S2 MW 449.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F2N3O2S2/c1-12-5-13(2)10-25(9-12)18(27)11-30-21-24-17-3-4-29-19(17)20(28)26(21)16-7-14(22)6-15(23)8-16/h3-4,6-8,12-13H,5,9-11H2,1-2H3
InChIKey
SOKQRHWZNZZJOU-UHFFFAOYSA-N
Synonyms

3(35difluorophenyl)2((2(35dimethylpiperidin1yl)2oxoethyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(35difluorophenyl)2(2(35dimethylpiperidin1yl)2oxoethyl)sulfanylthieno(32d)pyrimidin4one
CC1CC(CN(C1)C(=O)CSC2=NC3=C(C(=O)N2C4=CC(=CC(=C4)F)F)SC=C3)C
InChI=1SC21H21F2N3O2S2c112513(2)1025(912)18(27)1130212417342919(17)20(28)26(21)16714(22)615(23)816h34681213H5911H212H3
MFCD18197963
ZINC000057489270
ZINC000057489277

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Available files

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