Vitas-M small molecule compound
(2E)-N-benzyl-3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyanoprop-2-enamide
Catalog ID
STK497495
SMILES N#C/C(=C\c1cc2OCOc2cc1Br)/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 C18H13BrN2O3 MW 385.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrN2O3/c19-15-8-17-16(23-11-24-17)7-13(15)6-14(9-20)18(22)21-10-12-4-2-1-3-5-12/h1-8H,10-11H2,(H,21,22)/b14-6+InChIKey
XNHMDXHMGNRDSC-MKMNVTDBSA-NSynonyms
(2E)3(6BROMO(2HBENZO(D)13DIOXOLAN5YL))2CYANONBENZYLPROP2ENAMIDE
(2E)Nbenzyl3(6bromo13benzodioxol5yl)2cyanoprop2enamide
(E)NBENZYL3(6BROMO13BENZODIOXOL5YL)2CYANOPROP2ENAMIDE
C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C(=O)NCC3=CC=CC=C3)Br
InChI=1SC18H13BrN2O3c191581716(23112417)713(15)614(920)18(22)2110124213512h18H1011H2(H2122)b146+
MFCD06115308
N#CC(=Cc1cc2OCOc2cc1Br)C(=O)NCc1ccccc1
ZINC000007156878
ZINC07156878
ZINC7156878
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