Vitas-M small molecule compound
ethyl (5-oxo-2-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-6(5H)-yl)acetate
Catalog ID
STK633098
SMILES CCOC(=O)Cn1c(=O)n2nc(nc2c2c1sc1c2CCCC1)c1ccccc1
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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 C21H20N4O3S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S/c1-2-28-16(26)12-24-20-17(14-10-6-7-11-15(14)29-20)19-22-18(23-25(19)21(24)27)13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3InChIKey
KRLGYUIKWBQTJV-UHFFFAOYSA-NSynonyms
951990-50-4951990504
CCOC(=O)CN1C2=C(C3=C(S2)CCCC3)C4=NC(=NN4C1=O)C5=CC=CC=C5
ethyl(5oxo2phenyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidin6(5H)yl)acetate
ethyl2(5oxo2phenyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidin6(5H)yl)acetate
InChI=1SC21H20N4O3Sc122816(26)12242017(1410671115(14)2920)192218(2325(19)21(24)27)138435913h3589H2671012H21H3
MFCD09857119
ZINC000013729061
ZINC13729061
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