Vitas-M small molecule compound
(2Z)-7-[(diethylammonio)methyl]-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK855612
SMILES CC[NH+](Cc1c([O-])cc(c2c1O/C(=C\c1cccnc1)/C2=O)C)CC
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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 C20H22N2O3 MW 338.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3/c1-4-22(5-2)12-15-16(23)9-13(3)18-19(24)17(25-20(15)18)10-14-7-6-8-21-11-14/h6-11,23H,4-5,12H2,1-3H3/b17-10-InChIKey
RMYXGKKVHZITRM-YVLHZVERSA-NSynonyms
903195-46-0(2Z)7((diethylammonio)methyl)4methyl3oxo2(pyridin3ylmethylidene)23dihydro1benzofuran6olate
(2Z)7((diethylazaniumyl)methyl)4methyl3oxo2(pyridin3ylmethylidene)1benzofuran6olate
903195460
CC(NH+)(CC)CC1=C(C=C(C2=C1OC(=CC3=CN=CC=C3)C2=O)C)(O)
CC(NH+)(Cc1c((O))cc(c2c1OC(=Cc1cccnc1)C2=O)C)CC
InChI=1SC20H22N2O3c1422(52)121516(23)913(3)1819(24)17(2520(15)18)1014768211114h61123H4512H213H3b1710
MFCD08287378
ZINC000020573566
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