Vitas-M small molecule compound
N-(4-chloro-2-fluorophenyl)-2-[5-(3,4-dihydroisoquinolin-2(1H)-yl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Catalog ID
STL079943
SMILES O=C(Cn1nc2n(c1=O)c(nc(c2)C)N1CCc2c(C1)cccc2)Nc1ccc(cc1F)Cl
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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 C23H20ClFN6O2 MW 466.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClFN6O2/c1-14-10-20-28-30(13-21(32)27-19-7-6-17(24)11-18(19)25)23(33)31(20)22(26-14)29-9-8-15-4-2-3-5-16(15)12-29/h2-7,10-11H,8-9,12-13H2,1H3,(H,27,32)InChIKey
YORYJZZLNJRIPK-UHFFFAOYSA-NSynonyms
CC1=CC2=NN(C(=O)N2C(=N1)N3CCC4=CC=CC=C4C3)CC(=O)NC5=C(C=C(C=C5)Cl)F
InChI=1SC23H20ClFN6O2c11410202830(1321(32)27197617(24)1118(19)25)23(33)31(20)22(2614)299815423516(15)1229h271011H891213H21H3(H2732)
MFCD18200709
N(4chloro2fluorophenyl)2(5(34dihydro1Hisoquinolin2yl)7methyl3oxo(124)triazolo(43c)pyrimidin2yl)acetamide
N(4chloro2fluorophenyl)2(5(34dihydroisoquinolin2(1H)yl)7methyl3oxo(124)triazolo(43c)pyrimidin2(3H)yl)acetamide
ZINC000057505881
ZINC57505881
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