Vitas-M small molecule compound
(2E)-3-[5-(3-bromo-4-methylphenyl)furan-2-yl]-2-(4-nitrophenyl)prop-2-enenitrile
Catalog ID
STL384153
SMILES N#C/C(=C/c1ccc(o1)c1ccc(c(c1)Br)C)/c1ccc(cc1)[N+](=O)[O-]
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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 C20H13BrN2O3 MW 409.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrN2O3/c1-13-2-3-15(11-19(13)21)20-9-8-18(26-20)10-16(12-22)14-4-6-17(7-5-14)23(24)25/h2-11H,1H3/b16-10-InChIKey
HMUNKOYFDBZMRN-YBEGLDIGSA-NSynonyms
(2E)3(5(3bromo4methylphenyl)furan2yl)2(4nitrophenyl)prop2enenitrile
(E)3(5(3BROMO4METHYLPHENYL)FURAN2YL)2(4NITROPHENYL)PROP2ENENITRILE
CC1=C(C=C(C=C1)C2=CC=C(O2)C=C(C#N)C3=CC=C(C=C3)(N+)(=O)(O))Br
InChI=1SC20H13BrN2O3c1132315(1119(13)21)209818(2620)1016(1222)144617(7514)23(24)25h211H1H3b1610
MFCD05991718
N#CC(=Cc1ccc(o1)c1ccc(c(c1)Br)C)c1ccc(cc1)(N+)(=O)(O)
ZINC000016361169
ZINC16361169
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