Vitas-M small molecule compound

N-{(1E)-1-(2-fluorophenyl)-3-[(2-methoxyethyl)amino]-3-oxoprop-1-en-2-yl}-4-methylbenzamide

Catalog ID
STK821822
SMILES COCCNC(=O)/C(=C\c1ccccc1F)/NC(=O)c1ccc(cc1)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 C20H21FN2O3 MW 356.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN2O3/c1-14-7-9-15(10-8-14)19(24)23-18(20(25)22-11-12-26-2)13-16-5-3-4-6-17(16)21/h3-10,13H,11-12H2,1-2H3,(H,22,25)(H,23,24)/b18-13+
InChIKey
LOLXDHAFVQIREH-QGOAFFKASA-N
Synonyms

(2E)3(2FLUOROPHENYL)N(2METHOXYETHYL)2((4METHYLPHENYL)FORMAMIDO)PROP2ENAMIDE
CC1=CC=C(C=C1)C(=O)NC(=CC2=CC=CC=C2F)C(=O)NCCOC
COCCNC(=O)C(=Cc1ccccc1F)NC(=O)c1ccc(cc1)C
InChI=1SC20H21FN2O3c1147915(10814)19(24)2318(20(25)221112262)1316534617(16)21h31013H1112H212H3(H2225)(H2324)b1813+
MFCD00680790
N((1E)1(2fluorophenyl)3((2methoxyethyl)amino)3oxoprop1en2yl)4methylbenzamide
N((E)1(2FLUOROPHENYL)3(2METHOXYETHYLAMINO)3OXOPROP1EN2YL)4METHYLBENZAMIDE
N(2(2FLUOROPHENYL)1(2METHOXYETHYLCARBAMOYL)VINYL)4METHYLBENZAMIDE
ZINC000003055571
ZINC03055571
ZINC3055571

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.