Vitas-M small molecule compound

(2E)-2-cyano-3-(4-propoxyphenyl)-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide

Catalog ID
STK804922
SMILES CCCOc1ccc(cc1)/C=C(/C(=O)NCC1CCCO1)\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 C18H22N2O3 MW 314.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O3/c1-2-9-22-16-7-5-14(6-8-16)11-15(12-19)18(21)20-13-17-4-3-10-23-17/h5-8,11,17H,2-4,9-10,13H2,1H3,(H,20,21)/b15-11+
InChIKey
DOIHDBFYHAQHKV-RVDMUPIBSA-N
Synonyms

(2E)2cyano3(4propoxyphenyl)N(tetrahydrofuran2ylmethyl)prop2enamide
(E)2cyanoN(oxolan2ylmethyl)3(4propoxyphenyl)prop2enamide
CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NCC2CCCO2
CCCOc1ccc(cc1)C=C(C(=O)NCC1CCCO1)C#N
InChI=1SC18H22N2O3c12922167514(6816)1115(1219)18(21)20131743102317h581117H2491013H21H3(H2021)b1511+
MFCD03463725
ZINC000023724004
ZINC000023724006

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Available files

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