Vitas-M small molecule compound

(2Z)-3-{3-[(4-tert-butylphenoxy)methyl]-4-methoxyphenyl}-2-cyano-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide

Catalog ID
STK473189
SMILES N#C/C(=C/c1ccc(c(c1)COc1ccc(cc1)C(C)(C)C)OC)/C(=O)NCC1CCCO1

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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 C27H32N2O4 MW 448.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O4/c1-27(2,3)22-8-10-23(11-9-22)33-18-21-15-19(7-12-25(21)31-4)14-20(16-28)26(30)29-17-24-6-5-13-32-24/h7-12,14-15,24H,5-6,13,17-18H2,1-4H3,(H,29,30)/b20-14-
InChIKey
VIXRYCONVCDEJH-ZHZULCJRSA-N
Synonyms

(2Z)3(3((4(TERTBUTYL)PHENOXY)METHYL)4METHOXYPHENYL)2CYANON(OXOLAN2YLMETHYL)PROP2ENAMIDE
(2Z)3(3((4tertbutylphenoxy)methyl)4methoxyphenyl)2cyanoN(tetrahydrofuran2ylmethyl)prop2enamide
(Z)3(3((4tertbutylphenoxy)methyl)4methoxyphenyl)2cyanoN(oxolan2ylmethyl)prop2enamide
CC(C)(C)C1=CC=C(C=C1)OCC2=C(C=CC(=C2)C=C(C#N)C(=O)NCC3CCCO3)OC
InChI=1SC27H32N2O4c127(23)2281023(11922)3318211519(71225(21)314)1420(1628)26(30)29172465133224h712141524H56131718H214H3(H2930)b2014
MFCD07077484
N#CC(=Cc1ccc(c(c1)COc1ccc(cc1)C(C)(C)C)OC)C(=O)NCC1CCCO1
ZINC000019647745
ZINC000019647748

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Available files

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