Vitas-M small molecule compound
3-{(2E)-3-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]prop-2-enoyl}-2H-chromen-2-one
Catalog ID
STL181701
SMILES COc1ccc(cc1)c1n[nH]cc1/C=C/C(=O)c1cc2ccccc2oc1=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 C22H16N2O4 MW 372.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N2O4/c1-27-17-9-6-14(7-10-17)21-16(13-23-24-21)8-11-19(25)18-12-15-4-2-3-5-20(15)28-22(18)26/h2-13H,1H3,(H,23,24)/b11-8+InChIKey
XYADMOKYTDPSAC-DHZHZOJOSA-NSynonyms
1263038-24-91263038249
3((2E)3(3(4methoxyphenyl)1Hpyrazol4yl)prop2enoyl)2Hchromen2one
3((2E)3(3(4METHOXYPHENYL)PYRAZOL4YL)PROP2ENOYL)CHROMEN2ONE
3((E)3(5(4methoxyphenyl)1Hpyrazol4yl)prop2enoyl)chromen2one
COC1=CC=C(C=C1)C2=C(C=NN2)C=CC(=O)C3=CC4=CC=CC=C4OC3=O
COc1ccc(cc1)c1n(nH)cc1C=CC(=O)c1cc2ccccc2oc1=O
InChI=1SC22H16N2O4c127179614(71017)2116(13232421)81119(25)181215423520(15)2822(18)26h213H1H3(H2324)b118+
MFCD20760075
ZINC000071785023
ZINC71785023
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