Vitas-M small molecule compound
(2Z)-7-[(diethylammonio)methyl]-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK847728
SMILES CC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(o1)C)/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 C19H21NO4 MW 327.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO4/c1-4-20(5-2)11-15-16(21)9-8-14-18(22)17(24-19(14)15)10-13-7-6-12(3)23-13/h6-10,21H,4-5,11H2,1-3H3/b17-10-InChIKey
ABBXGIDDLAHSHZ-YVLHZVERSA-NSynonyms
899395-07-4(2Z)7((diethylammonio)methyl)2((5methylfuran2yl)methylidene)3oxo23dihydro1benzofuran6olate
(2Z)7(DIETHYLAMINOMETHYL)6HYDROXY2((5METHYLFURAN2YL)METHYLIDENE)1BENZOFURAN3ONE
7((DIETHYLAMINO)METHYL)6HYDROXY2((5METHYL(2FURYL))METHYLENE)BENZO(B)FURAN3ONE
899395074
CC(NH+)(Cc1c((O))ccc2c1OC(=Cc1ccc(o1)C)C2=O)CC
CCN(CC)CC1=C(C=CC2=C1OC(=CC3=CC=C(O3)C)C2=O)O
InChI=1SC19H21NO4c1420(52)111516(21)981418(22)17(2419(14)15)10137612(3)2313h61021H4511H213H3b1710
MFCD06606406
ZINC000020533160
ZINC20533160
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