Vitas-M small molecule compound

(2Z)-7-[(diethylammonio)methyl]-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate

Catalog ID
STK851699
SMILES CC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccnc1)/C2=O)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 C19H20N2O3 MW 324.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O3/c1-3-21(4-2)12-15-16(22)8-7-14-18(23)17(24-19(14)15)10-13-6-5-9-20-11-13/h5-11,22H,3-4,12H2,1-2H3/b17-10-
InChIKey
IENZHOIPKYAEPJ-YVLHZVERSA-N
Synonyms
896808-19-8
(2Z)7((diethylammonio)methyl)3oxo2(pyridin3ylmethylidene)23dihydro1benzofuran6olate
(2Z)7(DIETHYLAMINOMETHYL)6HYDROXY2(PYRIDIN3YLMETHYLIDENE)1BENZOFURAN3ONE
7((DIETHYLAMINO)METHYL)6HYDROXY2(3PYRIDYLMETHYLENE)BENZO(B)FURAN3ONE
896808198
CC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cccnc1)C2=O)CC
CCN(CC)CC1=C(C=CC2=C1OC(=CC3=CN=CC=C3)C2=O)O
InChI=1SC19H20N2O3c1321(42)121516(22)871418(23)17(2419(14)15)1013659201113h51122H3412H212H3b1710
MFCD06595820
ZINC000020504074
ZINC20504074

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Available files

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