Vitas-M small molecule compound

(2Z)-N-(4-butylphenyl)-2-cyano-3-(4-fluorophenyl)prop-2-enamide

Catalog ID
STK443463
SMILES CCCCc1ccc(cc1)NC(=O)/C(=C\c1ccc(cc1)F)/C#N

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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 C20H19FN2O MW 322.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19FN2O/c1-2-3-4-15-7-11-19(12-8-15)23-20(24)17(14-22)13-16-5-9-18(21)10-6-16/h5-13H,2-4H2,1H3,(H,23,24)/b17-13-
InChIKey
RABFGNUTCDLOAY-LGMDPLHJSA-N
Synonyms

(2Z)N(4butylphenyl)2cyano3(4fluorophenyl)prop2enamide
(Z)N(4butylphenyl)2cyano3(4fluorophenyl)prop2enamide
CCCCC1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)F)C#N
CCCCc1ccc(cc1)NC(=O)C(=Cc1ccc(cc1)F)C#N
InChI=1SC20H19FN2Oc12341571119(12815)2320(24)17(1422)13165918(21)10616h513H24H21H3(H2324)b1713
MFCD04054746
ZINC000006399453
ZINC06399453
ZINC6399453

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Available files

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