Vitas-M small molecule compound
N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
Catalog ID
STL080144
SMILES O=C(Cn1c(=O)cc(nc1N1CCc2c(C1)cccc2)C)Nc1cc2OCOc2cc1C(=O)C
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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 C25H24N4O5 MW 460.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O5/c1-15-9-24(32)29(25(26-15)28-8-7-17-5-3-4-6-18(17)12-28)13-23(31)27-20-11-22-21(33-14-34-22)10-19(20)16(2)30/h3-6,9-11H,7-8,12-14H2,1-2H3,(H,27,31)InChIKey
RWTNLYTXKOXEEH-UHFFFAOYSA-NSynonyms
CC1=CC(=O)N(C(=N1)N2CCC3=CC=CC=C3C2)CC(=O)NC4=CC5=C(C=C4C(=O)C)OCO5
InChI=1SC25H24N4O5c115924(32)29(25(2615)288717534618(17)1228)1323(31)2720112221(33143422)1019(20)16(2)30h36911H781214H212H3(H2731)
MFCD18200910
N(6acetyl13benzodioxol5yl)2(2(34dihydro1Hisoquinolin2yl)4methyl6oxopyrimidin1yl)acetamide
N(6acetyl13benzodioxol5yl)2(2(34dihydroisoquinolin2(1H)yl)4methyl6oxopyrimidin1(6H)yl)acetamide
ZINC000057506671
ZINC57506671
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