Vitas-M small molecule compound
(2E)-N-benzyl-2-cyano-3-{3-methoxy-4-[2-(4-methylphenoxy)ethoxy]phenyl}prop-2-enamide
Catalog ID
STK006149
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCCOc1ccc(cc1)C)/C(=O)NCc1ccccc1
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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 C27H26N2O4 MW 442.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O4/c1-20-8-11-24(12-9-20)32-14-15-33-25-13-10-22(17-26(25)31-2)16-23(18-28)27(30)29-19-21-6-4-3-5-7-21/h3-13,16-17H,14-15,19H2,1-2H3,(H,29,30)/b23-16+InChIKey
GPVLCVPQJHGXLG-XQNSMLJCSA-NSynonyms
(2E)NBENZYL2CYANO3(3METHOXY4(2(4METHYLPHENOXY)ETHOXY)PHENYL)PROP2ENAMIDE
(E)NBENZYL2CYANO3(3METHOXY4(2(4METHYLPHENOXY)ETHOXY)PHENYL)PROP2ENAMIDE
CC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=C(C#N)C(=O)NCC3=CC=CC=C3)OC
InChI=1SC27H26N2O4c12081124(12920)3214153325131022(1726(25)312)1623(1828)27(30)2919216435721h3131617H141519H212H3(H2930)b2316+
MFCD02204035
N#CC(=Cc1ccc(c(c1)OC)OCCOc1ccc(cc1)C)C(=O)NCc1ccccc1
STK006149
ZINC000012285294
ZINC12285294
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