Vitas-M small molecule compound
2-(4-{[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]methyl}piperazin-1-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STL156182
SMILES OCc1oc(CN2CCN(CC2)c2nc3CCCCc3cc2C#N)c(c(=O)c1)O
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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 C21H24N4O4 MW 396.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O4/c22-11-15-9-14-3-1-2-4-17(14)23-21(15)25-7-5-24(6-8-25)12-19-20(28)18(27)10-16(13-26)29-19/h9-10,26,28H,1-8,12-13H2InChIKey
JQZHKZMAPJOHIX-UHFFFAOYSA-NSynonyms
1324090-63-21324090632
2(4((3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)methyl)piperazin1yl)5678tetrahydroquinoline3carbonitrile
2(4((3hydroxy6(hydroxymethyl)4oxopyran2yl)methyl)piperazin1yl)5678tetrahydroquinoline3carbonitrile
C1CCC2=C(C1)C=C(C(=N2)N3CCN(CC3)CC4=C(C(=O)C=C(O4)CO)O)C#N
InChI=1SC21H24N4O4c221115914312417(14)2321(15)257524(6825)121920(28)18(27)1016(1326)2919h9102628H181213H2
MFCD19708072
ZINC000071279137
ZINC71279137
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