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-ethylphenyl)acetamide
Catalog ID
STL079946
SMILES CCc1cccc(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 C25H26N6O2 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N6O2/c1-3-18-7-6-10-21(14-18)27-23(32)16-30-25(33)31-22(28-30)13-17(2)26-24(31)29-12-11-19-8-4-5-9-20(19)15-29/h4-10,13-14H,3,11-12,15-16H2,1-2H3,(H,27,32)InChIKey
IBBCRAMGXUKBRR-UHFFFAOYSA-NSynonyms
2(5(34dihydro1Hisoquinolin2yl)7methyl3oxo(124)triazolo(43c)pyrimidin2yl)N(3ethylphenyl)acetamide
2(5(34dihydroisoquinolin2(1H)yl)7methyl3oxo(124)triazolo(43c)pyrimidin2(3H)yl)N(3ethylphenyl)acetamide
CCC1=CC(=CC=C1)NC(=O)CN2C(=O)N3C(=N2)C=C(N=C3N4CCC5=CC=CC=C5C4)C
InChI=1SC25H26N6O2c1318761021(1418)2723(32)163025(33)3122(2830)1317(2)2624(31)29121119845920(19)1529h4101314H311121516H212H3(H2732)
MFCD18200712
ZINC000057505886
ZINC57505886
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