Vitas-M small molecule compound
ethyl 3-{[(1E)-3-(2,5-dimethylphenyl)-3-oxoprop-1-en-1-yl]amino}benzoate
Catalog ID
STK902676
SMILES CCOC(=O)c1cccc(c1)N/C=C/C(=O)c1cc(C)ccc1C
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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/c1-4-24-20(23)16-6-5-7-17(13-16)21-11-10-19(22)18-12-14(2)8-9-15(18)3/h5-13,21H,4H2,1-3H3/b11-10+InChIKey
XTOHTZCRSWMDKK-ZHACJKMWSA-NSynonyms
CCOC(=O)C1=CC(=CC=C1)NC=CC(=O)C2=C(C=CC(=C2)C)C
CCOC(=O)c1cccc(c1)NC=CC(=O)c1cc(C)ccc1C
ethyl3(((1E)3(25dimethylphenyl)3oxoprop1en1yl)amino)benzoate
ethyl3(((E)3(25dimethylphenyl)3oxoprop1enyl)amino)benzoate
InChI=1SC20H21NO3c142420(23)1665717(1316)21111019(22)181214(2)8915(18)3h51321H4H213H3b1110+
MFCD18175184
ZINC000044844453
ZINC44844453
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