Vitas-M small molecule compound
4-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-3-phenyl-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Catalog ID
STK784357
SMILES COc1cc(ccc1OCc1ccccc1F)C1CC(=O)Oc2c1c(n[nH]2)c1ccccc1
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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 C26H21FN2O4 MW 444.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN2O4/c1-31-22-13-17(11-12-21(22)32-15-18-9-5-6-10-20(18)27)19-14-23(30)33-26-24(19)25(28-29-26)16-7-3-2-4-8-16/h2-13,19H,14-15H2,1H3,(H,28,29)InChIKey
GEZVUTFAACMJOP-UHFFFAOYSA-NSynonyms
4(4((2fluorobenzyl)oxy)3methoxyphenyl)3phenyl45dihydropyrano(23c)pyrazol6(1H)one
4(4((2FLUOROPHENYL)METHOXY)3METHOXYPHENYL)3PHENYL45DIHYDRO2HPYRANO(23C)PYRAZOL6ONE
COC1=C(C=CC(=C1)C2CC(=O)OC3=NNC(=C23)C4=CC=CC=C4)OCC5=CC=CC=C5F
COc1cc(ccc1OCc1ccccc1F)C1CC(=O)Oc2c1c(n(nH)2)c1ccccc1
InChI=1SC26H21FN2O4c131221317(111221(22)3215189561020(18)27)191423(30)332624(19)25(282926)167324816h21319H1415H21H3(H2829)
MFCD07021929
ZINC000012419606
ZINC000012419609
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