Vitas-M small molecule compound
N-(3-chloro-4-fluorobenzyl)-2-{[3-(4-fluorobenzyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL028629
SMILES O=C(CSc1nc2ccsc2c(=O)n1Cc1ccc(cc1)F)NCc1ccc(c(c1)Cl)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/c23-16-9-14(3-6-17(16)25)10-26-19(29)12-32-22-27-18-7-8-31-20(18)21(30)28(22)11-13-1-4-15(24)5-2-13/h1-9H,10-12H2,(H,26,29)InChIKey
YGHRGRFPSOWMGA-UHFFFAOYSA-NSynonyms
1252861-45-21252861452
C1=CC(=CC=C1CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)NCC4=CC(=C(C=C4)F)Cl)F
InChI=1SC22H16ClF2N3O2S2c2316914(3617(16)25)102619(29)1232222718783120(18)21(30)28(22)11131415(24)5213h19H1012H2(H2629)
MFCD18189015
N((3chloro4fluorophenyl)methyl)2(3((4fluorophenyl)methyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
N(3chloro4fluorobenzyl)2((3(4fluorobenzyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067689781
ZINC67689781
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