Vitas-M small molecule compound
(2E)-N-benzyl-3-{2-[(4-bromobenzyl)oxy]naphthalen-1-yl}-2-cyanoprop-2-enamide
Catalog ID
STK065795
SMILES N#C/C(=C\c1c(OCc2ccc(cc2)Br)ccc2c1cccc2)/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 C28H21BrN2O2 MW 497.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21BrN2O2/c29-24-13-10-21(11-14-24)19-33-27-15-12-22-8-4-5-9-25(22)26(27)16-23(17-30)28(32)31-18-20-6-2-1-3-7-20/h1-16H,18-19H2,(H,31,32)/b23-16+InChIKey
OUDRDTLEIJGZPR-XQNSMLJCSA-NSynonyms
(2E)NBENZYL3(2((4BROMOBENZYL)OXY)NAPHTHALEN1YL)2CYANOPROP2ENAMIDE
(E)NBENZYL3(2((4BROMOPHENYL)METHOXY)NAPHTHALEN1YL)2CYANOPROP2ENAMIDE
C1=CC=C(C=C1)CNC(=O)C(=CC2=C(C=CC3=CC=CC=C32)OCC4=CC=C(C=C4)Br)C#N
InChI=1SC28H21BrN2O2c2924131021(111424)193327151222845925(22)26(27)1623(1730)28(32)3118206213720h116H1819H2(H3132)b2316+
MFCD04227179
N#CC(=Cc1c(OCc2ccc(cc2)Br)ccc2c1cccc2)C(=O)NCc1ccccc1
STK065795
ZINC000003765066
ZINC03765066
ZINC3765066
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