Vitas-M small molecule compound
3-(3-hydroxy-5-phenyl-1H-pyrazol-4-yl)-6,7-dimethoxy-2-benzofuran-1(3H)-one
Catalog ID
STK626122
SMILES COc1c(OC)ccc2c1C(=O)OC2c1c(O)n[nH]c1c1ccccc1
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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 C19H16N2O5 MW 352.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O5/c1-24-12-9-8-11-13(17(12)25-2)19(23)26-16(11)14-15(20-21-18(14)22)10-6-4-3-5-7-10/h3-9,16H,1-2H3,(H2,20,21,22)InChIKey
ANQZDMGJNYKOJM-UHFFFAOYSA-NSynonyms
956945-20-33(3hydroxy5phenyl1Hpyrazol4yl)67dimethoxy2benzofuran1(3H)one
3(5hydroxy3phenyl1Hpyrazol4yl)67dimethoxyisobenzofuran1(3H)one
4(45dimethoxy3oxo1H2benzofuran1yl)5phenyl12dihydropyrazol3one
956945203
COC1=C(C2=C(C=C1)C(OC2=O)C3=C(NNC3=O)C4=CC=CC=C4)OC
COc1c(OC)ccc2c1C(=O)OC2c1c(O)(nH)nc1c1ccccc1
COc1c(OC)ccc2c1C(=O)OC2c1c(O)n(nH)c1c1ccccc1
InChI=1SC19H16N2O5c12412981113(17(12)252)19(23)2616(11)1415(202118(14)22)106435710h3916H12H3(H2202122)
MFCD09795069
ZINC000009059597
ZINC000009059598
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