Vitas-M small molecule compound
4-{4-[(2-chlorobenzyl)oxy]phenyl}-3-(4-methoxyphenyl)-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Catalog ID
STK784414
SMILES COc1ccc(cc1)c1n[nH]c2c1C(CC(=O)O2)c1ccc(cc1)OCc1ccccc1Cl
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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 C26H21ClN2O4 MW 460.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN2O4/c1-31-19-10-8-17(9-11-19)25-24-21(14-23(30)33-26(24)29-28-25)16-6-12-20(13-7-16)32-15-18-4-2-3-5-22(18)27/h2-13,21H,14-15H2,1H3,(H,28,29)InChIKey
GOTFJIGNDMKADB-UHFFFAOYSA-NSynonyms
4(4((2chlorobenzyl)oxy)phenyl)3(4methoxyphenyl)45dihydropyrano(23c)pyrazol6(1H)one
4(4((2CHLOROPHENYL)METHOXY)PHENYL)3(4METHOXYPHENYL)45DIHYDRO2HPYRANO(23C)PYRAZOL6ONE
COC1=CC=C(C=C1)C2=C3C(CC(=O)OC3=NN2)C4=CC=C(C=C4)OCC5=CC=CC=C5Cl
COc1ccc(cc1)c1n(nH)c2c1C(CC(=O)O2)c1ccc(cc1)OCc1ccccc1Cl
InChI=1SC26H21ClN2O4c1311910817(91119)252421(1423(30)3326(24)292825)1661220(13716)321518423522(18)27h21321H1415H21H3(H2829)
MFCD07022246
ZINC000012370976
ZINC000012370977
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