Vitas-M small molecule compound
methyl 3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-3-(quinoxalin-6-yl)propanoate
Catalog ID
STL310100
SMILES COC(=O)CC(c1c(C)[nH]nc1O)c1ccc2c(c1)nccn2
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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 C16H16N4O3 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O3/c1-9-15(16(22)20-19-9)11(8-14(21)23-2)10-3-4-12-13(7-10)18-6-5-17-12/h3-7,11H,8H2,1-2H3,(H2,19,20,22)InChIKey
YJXMKZQOWLQRAZ-UHFFFAOYSA-NSynonyms
1435981-04-61435981046
CC1=C(C(=O)NN1)C(CC(=O)OC)C2=CC3=NC=CN=C3C=C2
COC(=O)CC(c1c(C)(nH)nc1O)c1ccc2c(c1)nccn2
InChI=1SC16H16N4O3c1915(16(22)20199)11(814(21)232)10341213(710)18651712h3711H8H212H3(H2192022)
methyl3(3hydroxy5methyl1Hpyrazol4yl)3(quinoxalin6yl)propanoate
methyl3(3methyl5oxo12dihydropyrazol4yl)3quinoxalin6ylpropanoate
MFCD28025323
ZINC000095473088
ZINC000095473089
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