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-ethyl-N-(3-methylphenyl)acetamide
Catalog ID
STL079913
SMILES CCN(C(=O)Cn1nc2n(c1=O)c(nc(c2)C)N1CCc2c(C1)cccc2)c1cccc(c1)C
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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 C26H28N6O2 MW 456.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O2/c1-4-30(22-11-7-8-18(2)14-22)24(33)17-31-26(34)32-23(28-31)15-19(3)27-25(32)29-13-12-20-9-5-6-10-21(20)16-29/h5-11,14-15H,4,12-13,16-17H2,1-3H3InChIKey
FLPBAAXXHCTRAF-UHFFFAOYSA-NSynonyms
2(5(34dihydro1Hisoquinolin2yl)7methyl3oxo(124)triazolo(43c)pyrimidin2yl)NethylN(3methylphenyl)acetamide
2(5(34dihydroisoquinolin2(1H)yl)7methyl3oxo(124)triazolo(43c)pyrimidin2(3H)yl)NethylN(3methylphenyl)acetamide
CCN(C1=CC=CC(=C1)C)C(=O)CN2C(=O)N3C(=N2)C=C(N=C3N4CCC5=CC=CC=C5C4)C
InChI=1SC26H28N6O2c1430(22117818(2)1422)24(33)173126(34)3223(2831)1519(3)2725(32)291312209561021(20)1629h5111415H412131617H213H3
MFCD18200679
ZINC000057505733
ZINC57505733
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