Vitas-M small molecule compound
N-(2-chlorophenyl)-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
STL079908
SMILES O=C(Cn1nc2n(c1=O)c(nc(c2)C)N1CCc2c(C1)cccc2)Nc1ccccc1Cl
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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 C23H21ClN6O2 MW 448.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN6O2/c1-15-12-20-27-29(14-21(31)26-19-9-5-4-8-18(19)24)23(32)30(20)22(25-15)28-11-10-16-6-2-3-7-17(16)13-28/h2-9,12H,10-11,13-14H2,1H3,(H,26,31)InChIKey
PLIUMRUEDQEBAR-UHFFFAOYSA-NSynonyms
CC1=CC2=NN(C(=O)N2C(=N1)N3CCC4=CC=CC=C4C3)CC(=O)NC5=CC=CC=C5Cl
InChI=1SC23H21ClN6O2c11512202729(1421(31)2619954818(19)24)23(32)30(20)22(2515)28111016623717(16)1328h2912H10111314H21H3(H2631)
MFCD18200674
N(2chlorophenyl)2(5(34dihydro1Hisoquinolin2yl)7methyl3oxo(124)triazolo(43c)pyrimidin2yl)acetamide
N(2chlorophenyl)2(5(34dihydroisoquinolin2(1H)yl)7methyl3oxo(124)triazolo(43c)pyrimidin2(3H)yl)acetamide
ZINC000057505722
ZINC57505722
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