Vitas-M small molecule compound
N-(2-chloro-4-fluorobenzyl)-2-{[3-(4-fluoro-3-methylphenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL076869
SMILES O=C(CSc1nc2ccsc2c(=O)n1c1ccc(c(c1)C)F)NCc1ccc(cc1Cl)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 C22H16ClF2N3O2S2 MW 491.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClF2N3O2S2/c1-12-8-15(4-5-17(12)25)28-21(30)20-18(6-7-31-20)27-22(28)32-11-19(29)26-10-13-2-3-14(24)9-16(13)23/h2-9H,10-11H2,1H3,(H,26,29)InChIKey
ZMXZODJIDCTVHO-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)NCC4=C(C=C(C=C4)F)Cl)F
InChI=1SC22H16ClF2N3O2S2c112815(4517(12)25)2821(30)2018(673120)2722(28)321119(29)2610132314(24)916(13)23h29H1011H21H3(H2629)
MFCD18198101
N((2chloro4fluorophenyl)methyl)2(3(4fluoro3methylphenyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
N(2chloro4fluorobenzyl)2((3(4fluoro3methylphenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067217801
ZINC67217801
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