Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-[3-(2-fluorobenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide
Catalog ID
STL073792
SMILES O=C(Cn1c(=O)n(Cc2ccccc2F)c(=O)c2c1ccs2)Nc1ccc2c(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 C22H16FN3O5S MW 453.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16FN3O5S/c23-15-4-2-1-3-13(15)10-26-21(28)20-16(7-8-32-20)25(22(26)29)11-19(27)24-14-5-6-17-18(9-14)31-12-30-17/h1-9H,10-12H2,(H,24,27)InChIKey
SADVKQDOLFVMJR-UHFFFAOYSA-NSynonyms
1260621-30-41260621304
C1OC2=C(O1)C=C(C=C2)NC(=O)CN3C4=C(C(=O)N(C3=O)CC5=CC=CC=C5F)SC=C4
InChI=1SC22H16FN3O5Sc2315421313(15)102621(28)2016(783220)25(22(26)29)1119(27)2414561718(914)31123017h19H1012H2(H2427)
MFCD18195236
N(13benzodioxol5yl)2(3((2fluorophenyl)methyl)24dioxothieno(32d)pyrimidin1yl)acetamide
N(13benzodioxol5yl)2(3(2fluorobenzyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
ZINC000057485993
ZINC57485993
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