Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-2-{[3-(4-fluoro-2-methylphenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL076554
SMILES O=C(Nc1cccc(c1C)Cl)CSc1nc2ccsc2c(=O)n1c1ccc(cc1C)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 C22H17ClFN3O2S2 MW 473.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClFN3O2S2/c1-12-10-14(24)6-7-18(12)27-21(29)20-17(8-9-30-20)26-22(27)31-11-19(28)25-16-5-3-4-15(23)13(16)2/h3-10H,11H2,1-2H3,(H,25,28)InChIKey
JJXMUAPIQKTANT-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)F)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)NC4=C(C(=CC=C4)Cl)C
InChI=1SC22H17ClFN3O2S2c1121014(24)6718(12)2721(29)2017(893020)2622(27)311119(28)251653415(23)13(16)2h310H11H212H3(H2528)
MFCD18197786
N(3chloro2methylphenyl)2((3(4fluoro2methylphenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
N(3chloro2methylphenyl)2(3(4fluoro2methylphenyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
ZINC000067217426
ZINC67217426
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