Vitas-M small molecule compound
methyl 4-({(1E)-3-oxo-3-[4-(propan-2-yl)phenyl]prop-1-en-1-yl}amino)benzoate
Catalog ID
STK987029
SMILES COC(=O)c1ccc(cc1)N/C=C/C(=O)c1ccc(cc1)C(C)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 C20H21NO3 MW 323.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO3/c1-14(2)15-4-6-16(7-5-15)19(22)12-13-21-18-10-8-17(9-11-18)20(23)24-3/h4-14,21H,1-3H3/b13-12+InChIKey
ULGNVFRXEJROOB-OUKQBFOZSA-NSynonyms
CC(C)C1=CC=C(C=C1)C(=O)C=CNC2=CC=C(C=C2)C(=O)OC
COC(=O)c1ccc(cc1)NC=CC(=O)c1ccc(cc1)C(C)C
InChI=1SC20H21NO3c114(2)154616(7515)19(22)1213211810817(91118)20(23)243h41421H13H3b1312+
methyl4(((1E)3oxo3(4(propan2yl)phenyl)prop1en1yl)amino)benzoate
methyl4(((E)3oxo3(4propan2ylphenyl)prop1enyl)amino)benzoate
MFCD18183882
ZINC000051318654
ZINC51318654
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