Vitas-M small molecule compound
N-(3-chloro-4-fluorophenyl)-2-{[3-(2-fluorobenzyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL029439
SMILES O=C(Nc1ccc(c(c1)Cl)F)CSc1nc2ccsc2c(=O)n1Cc1ccccc1F
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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 C21H14ClF2N3O2S2 MW 477.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClF2N3O2S2/c22-14-9-13(5-6-16(14)24)25-18(28)11-31-21-26-17-7-8-30-19(17)20(29)27(21)10-12-3-1-2-4-15(12)23/h1-9H,10-11H2,(H,25,28)InChIKey
JMPMCOFXIDXNDQ-UHFFFAOYSA-NSynonyms
C1=CC=C(C(=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)NC4=CC(=C(C=C4)F)Cl)F
InChI=1SC21H14ClF2N3O2S2c2214913(5616(14)24)2518(28)1131212617783019(17)20(29)27(21)1012312415(12)23h19H1011H2(H2528)
MFCD18189733
N(3chloro4fluorophenyl)2((3(2fluorobenzyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
N(3chloro4fluorophenyl)2(3((2fluorophenyl)methyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
ZINC000067689906
ZINC67689906
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