Vitas-M small molecule compound
(2E)-N-benzyl-3-{2-bromo-5-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-2-cyanoprop-2-enamide
Catalog ID
STK387610
SMILES N#C/C(=C\c1cc(OC)c(cc1Br)OCc1ccc(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 C26H23BrN2O3 MW 491.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23BrN2O3/c1-18-8-10-20(11-9-18)17-32-25-14-23(27)21(13-24(25)31-2)12-22(15-28)26(30)29-16-19-6-4-3-5-7-19/h3-14H,16-17H2,1-2H3,(H,29,30)/b22-12+InChIKey
RJLBPQAESXLHSR-WSDLNYQXSA-NSynonyms
(2E)3(2BROMO5METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)2CYANONBENZYLPROP2ENAMIDE
(2E)NBENZYL3(2BROMO5METHOXY4((4METHYLBENZYL)OXY)PHENYL)2CYANOPROP2ENAMIDE
(E)NBENZYL3(2BROMO5METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)2CYANOPROP2ENAMIDE
CC1=CC=C(C=C1)COC2=C(C=C(C(=C2)Br)C=C(C#N)C(=O)NCC3=CC=CC=C3)OC
InChI=1SC26H23BrN2O3c11881020(11918)1732251423(27)21(1324(25)312)1222(1528)26(30)2916196435719h314H1617H212H3(H2930)b2212+
MFCD01824734
N#CC(=Cc1cc(OC)c(cc1Br)OCc1ccc(cc1)C)C(=O)NCc1ccccc1
ZINC000004196415
ZINC04196415
ZINC4196415
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