Vitas-M small molecule compound

(2E)-3-[5-(2-bromo-4-nitrophenyl)furan-2-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile

Catalog ID
STK364868
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1Br)[N+](=O)[O-])/C(=O)N1CCN(CC1)c1ccccc1

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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 C24H19BrN4O4 MW 507.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19BrN4O4/c25-22-15-19(29(31)32)6-8-21(22)23-9-7-20(33-23)14-17(16-26)24(30)28-12-10-27(11-13-28)18-4-2-1-3-5-18/h1-9,14-15H,10-13H2/b17-14+
InChIKey
HWVNXSFNQVXRGL-SAPNQHFASA-N
Synonyms

(2E)3(5(2BROMO4NITROPHENYL)(2FURYL))2((4PHENYLPIPERAZINYL)CARBONYL)PROP2ENENITRILE
(2E)3(5(2BROMO4NITROPHENYL)FURAN2YL)2((4PHENYLPIPERAZIN1YL)CARBONYL)PROP2ENENITRILE
(E)3(5(2BROMO4NITROPHENYL)FURAN2YL)2(4PHENYLPIPERAZINE1CARBONYL)ACRYLONITRILE
(E)3(5(2BROMO4NITROPHENYL)FURAN2YL)2(4PHENYLPIPERAZINE1CARBONYL)PROP2ENENITRILE
C1CN(CCN1C2=CC=CC=C2)C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)(N+)(=O)(O))Br)C#N
InChI=1SC24H19BrN4O4c25221519(29(31)32)6821(22)239720(3323)1417(1626)24(30)28121027(111328)184213518h191415H1013H2b1714+
MFCD02104699
N#CC(=Cc1ccc(o1)c1ccc(cc1Br)(N+)(=O)(O))C(=O)N1CCN(CC1)c1ccccc1
ZINC000002289418
ZINC02289418
ZINC2289418

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.