Vitas-M small molecule compound
(2Z)-7-[(4-ethylpiperazin-1-yl)methyl]-2-(4-fluorobenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one
Catalog ID
STL033115
SMILES CCN1CCN(CC1)Cc1c(O)ccc2c1O/C(=C\c1ccc(cc1)F)/C2=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 C22H23FN2O3 MW 382.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN2O3/c1-2-24-9-11-25(12-10-24)14-18-19(26)8-7-17-21(27)20(28-22(17)18)13-15-3-5-16(23)6-4-15/h3-8,13,26H,2,9-12,14H2,1H3/b20-13-InChIKey
LKSWUIWPOGILPO-MOSHPQCFSA-NSynonyms
869078-57-9(2Z)7((4ethylpiperazin1ium1yl)methyl)2((4fluorophenyl)methylidene)3oxo1benzofuran6olate
(2Z)7((4ETHYLPIPERAZIN1YL)METHYL)2((4FLUOROPHENYL)METHYLIDENE)6HYDROXY1BENZOFURAN3ONE
(2Z)7((4ethylpiperazin1yl)methyl)2(4fluorobenzylidene)6hydroxy1benzofuran3(2H)one
7((4ETHYLPIPERAZINYL)METHYL)2((4FLUOROPHENYL)METHYLENE)6HYDROXYBENZO(B)FURAN3ONE
869078579
CCN1CC(NH+)(CC1)CC2=C(C=CC3=C2OC(=CC4=CC=C(C=C4)F)C3=O)(O)
CCN1CCN(CC1)Cc1c(O)ccc2c1OC(=Cc1ccc(cc1)F)C2=O
InChI=1SC22H23FN2O3c122491125(121024)141819(26)871721(27)20(2822(17)18)13153516(23)6415h381326H291214H21H3b2013
MFCD06405822
ZINC000022575505
ZINC22575505
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