Vitas-M small molecule compound
(2Z)-3-{3-bromo-4-[(4-nitrobenzyl)oxy]phenyl}-2-cyano-N-(furan-2-ylmethyl)prop-2-enamide
Catalog ID
STK182724
SMILES N#C/C(=C/c1ccc(c(c1)Br)OCc1ccc(cc1)[N+](=O)[O-])/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 C22H16BrN3O5 MW 482.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16BrN3O5/c23-20-11-16(10-17(12-24)22(27)25-13-19-2-1-9-30-19)5-8-21(20)31-14-15-3-6-18(7-4-15)26(28)29/h1-11H,13-14H2,(H,25,27)/b17-10-InChIKey
RGMJGXCPZBEYSZ-YVLHZVERSA-NSynonyms
(2Z)3(3BROMO4((4NITROBENZYL)OXY)PHENYL)2CYANON(FURAN2YLMETHYL)PROP2ENAMIDE
(Z)3(3bromo4((4nitrophenyl)methoxy)phenyl)2cyanoN(furan2ylmethyl)prop2enamide
C1=COC(=C1)CNC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))Br)C#N
InChI=1SC22H16BrN3O5c23201116(1017(1224)22(27)2513192193019)5821(20)3114153618(7415)26(28)29h111H1314H2(H2527)b1710
MFCD05041663
N#CC(=Cc1ccc(c(c1)Br)OCc1ccc(cc1)(N+)(=O)(O))C(=O)NCc1ccco1
ZINC000016430248
ZINC16430248
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