Vitas-M small molecule compound
N-(3-bromophenyl)-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
STL079956
SMILES Brc1cccc(c1)NC(=O)Cn1nc2n(c1=O)c(nc(c2)C)N1CCc2c(C1)cccc2
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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 C23H21BrN6O2 MW 493.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN6O2/c1-15-11-20-27-29(14-21(31)26-19-8-4-7-18(24)12-19)23(32)30(20)22(25-15)28-10-9-16-5-2-3-6-17(16)13-28/h2-8,11-12H,9-10,13-14H2,1H3,(H,26,31)InChIKey
LEHBAZSMLOJABA-UHFFFAOYSA-NSynonyms
CC1=CC2=NN(C(=O)N2C(=N1)N3CCC4=CC=CC=C4C3)CC(=O)NC5=CC(=CC=C5)Br
InChI=1SC23H21BrN6O2c11511202729(1421(31)261984718(24)1219)23(32)30(20)22(2515)2810916523617(16)1328h281112H9101314H21H3(H2631)
MFCD18200722
N(3bromophenyl)2(5(34dihydro1Hisoquinolin2yl)7methyl3oxo(124)triazolo(43c)pyrimidin2yl)acetamide
N(3bromophenyl)2(5(34dihydroisoquinolin2(1H)yl)7methyl3oxo(124)triazolo(43c)pyrimidin2(3H)yl)acetamide
ZINC000067219679
ZINC67219679
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