Vitas-M small molecule compound
2-[5-(3,4-dihydroisoquinolin-2(1H)-yl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(3,4-dimethoxybenzyl)acetamide
Catalog ID
STL079973
SMILES COc1cc(CNC(=O)Cn2nc3n(c2=O)c(nc(c3)C)N2CCc3c(C2)cccc3)ccc1OC
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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 C26H28N6O4 MW 488.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O4/c1-17-12-23-29-31(16-24(33)27-14-18-8-9-21(35-2)22(13-18)36-3)26(34)32(23)25(28-17)30-11-10-19-6-4-5-7-20(19)15-30/h4-9,12-13H,10-11,14-16H2,1-3H3,(H,27,33)InChIKey
OSWGRAZTCSKELS-UHFFFAOYSA-NSynonyms
2(5(34dihydro1Hisoquinolin2yl)7methyl3oxo(124)triazolo(43c)pyrimidin2yl)N((34dimethoxyphenyl)methyl)acetamide
2(5(34dihydroisoquinolin2(1H)yl)7methyl3oxo(124)triazolo(43c)pyrimidin2(3H)yl)N(34dimethoxybenzyl)acetamide
CC1=CC2=NN(C(=O)N2C(=N1)N3CCC4=CC=CC=C4C3)CC(=O)NCC5=CC(=C(C=C5)OC)OC
InChI=1SC26H28N6O4c11712232931(1624(33)2714188921(352)22(1318)363)26(34)32(23)25(2817)30111019645720(19)1530h491213H10111416H213H3(H2733)
MFCD18200739
ZINC000067219683
ZINC67219683
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