Vitas-M small molecule compound
N-(2-chloro-4-fluorobenzyl)-2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL076245
SMILES O=C(CSc1nc2ccsc2c(=O)n1c1ccc(cc1)Cl)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 C21H14Cl2FN3O2S2 MW 494.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14Cl2FN3O2S2/c22-13-2-5-15(6-3-13)27-20(29)19-17(7-8-30-19)26-21(27)31-11-18(28)25-10-12-1-4-14(24)9-16(12)23/h1-9H,10-11H2,(H,25,28)InChIKey
PQTUJGWPEDFXCF-UHFFFAOYSA-NSynonyms
1260995-04-71260995047
C1=CC(=CC=C1N2C(=O)C3=C(C=CS3)N=C2SCC(=O)NCC4=C(C=C(C=C4)F)Cl)Cl
InChI=1SC21H14Cl2FN3O2S2c22132515(6313)2720(29)1917(783019)2621(27)311118(28)2510121414(24)916(12)23h19H1011H2(H2528)
MFCD18197478
N((2chloro4fluorophenyl)methyl)2(3(4chlorophenyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
N(2chloro4fluorobenzyl)2((3(4chlorophenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067216766
ZINC67216766
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