Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2-{[3-(4-fluorobenzyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL028608
SMILES O=C(CSc1nc2ccsc2c(=O)n1Cc1ccc(cc1)F)NCc1ccc2c(c1)OCO2
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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 C23H18FN3O4S2 MW 483.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18FN3O4S2/c24-16-4-1-14(2-5-16)11-27-22(29)21-17(7-8-32-21)26-23(27)33-12-20(28)25-10-15-3-6-18-19(9-15)31-13-30-18/h1-9H,10-13H2,(H,25,28)InChIKey
NWKOSJHQFSARFX-UHFFFAOYSA-NSynonyms
C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NC4=C(C(=O)N3CC5=CC=C(C=C5)F)SC=C4
InChI=1SC23H18FN3O4S2c24164114(2516)112722(29)2117(783221)2623(27)331220(28)251015361819(915)31133018h19H1013H2(H2528)
MFCD18188994
N(13benzodioxol5ylmethyl)2((3(4fluorobenzyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
N(13benzodioxol5ylmethyl)2(3((4fluorophenyl)methyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
ZINC000067689769
ZINC67689769
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