Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-[5-(2,6-dibromo-4-nitrophenyl)furan-2-yl]prop-2-enenitrile
Catalog ID
STL431841
SMILES N#C/C(=C\c1ccc(o1)c1c(Br)cc(cc1Br)[N+](=O)[O-])/c1nc2c([nH]1)cccc2
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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 C20H10Br2N4O3 MW 514.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H10Br2N4O3/c21-14-8-12(26(27)28)9-15(22)19(14)18-6-5-13(29-18)7-11(10-23)20-24-16-3-1-2-4-17(16)25-20/h1-9H,(H,24,25)/b11-7+InChIKey
ZTMXBZALIGVLSP-YRNVUSSQSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(5(26dibromo4nitrophenyl)furan2yl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(5(26DIBROMO4NITROPHENYL)FURAN2YL)PROP2ENENITRILE
C1=CC=C2C(=C1)NC(=N2)C(=CC3=CC=C(O3)C4=C(C=C(C=C4Br)(N+)(=O)(O))Br)C#N
InChI=1SC20H10Br2N4O3c2114812(26(27)28)915(22)19(14)186513(2918)711(1023)202416312417(16)2520h19H(H2425)b117+
MFCD01158592
N#CC(=Cc1ccc(o1)c1c(Br)cc(cc1Br)(N+)(=O)(O))c1nc2c((nH)1)cccc2
ZINC000100164831
ZINC100164831
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