Vitas-M small molecule compound
(2Z)-2-(2-fluorobenzylidene)-6-hydroxy-4-methyl-5,7-bis[(4-methylpiperidin-1-yl)methyl]-1-benzofuran-3(2H)-one
Catalog ID
STL034483
SMILES CC1CCN(CC1)Cc1c(O)c(CN2CCC(CC2)C)c(c2c1O/C(=C\c1ccccc1F)/C2=O)C
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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 C30H37FN2O3 MW 492.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H37FN2O3/c1-19-8-12-32(13-9-19)17-23-21(3)27-29(35)26(16-22-6-4-5-7-25(22)31)36-30(27)24(28(23)34)18-33-14-10-20(2)11-15-33/h4-7,16,19-20,34H,8-15,17-18H2,1-3H3/b26-16-InChIKey
GJLHOWGUOIFAQA-QQXSKIMKSA-NSynonyms
(2Z)2((2fluorophenyl)methylidene)6hydroxy4methyl57bis((4methylpiperidin1yl)methyl)1benzofuran3one
(2Z)2(2fluorobenzylidene)6hydroxy4methyl57bis((4methylpiperidin1yl)methyl)1benzofuran3(2H)one
57BIS((4METHYLPIPERIDYL)METHYL)2((2FLUOROPHENYL)METHYLENE)6HYDROXY4METHYLBENZO(B)FURAN3ONE
CC1CCN(CC1)Cc1c(O)c(CN2CCC(CC2)C)c(c2c1OC(=Cc1ccccc1F)C2=O)C
CC1CCN(CC1)CC2=C(C(=C3C(=C2C)C(=O)C(=CC4=CC=CC=C4F)O3)CN5CCC(CC5)C)O
InChI=1SC30H37FN2O3c11981232(13919)172321(3)2729(35)26(1622645725(22)31)3630(27)24(28(23)34)1833141020(2)111533h4716192034H8151718H213H3b2616
MFCD10041313
ZINC000011865259
ZINC11865259
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