Vitas-M small molecule compound

(2E)-2-cyano-N-(2,4-dimethylphenyl)-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-enamide

Catalog ID
STL025898
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])/C(=O)Nc1ccc(cc1C)C

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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 C22H17N3O4 MW 387.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4/c1-14-3-9-20(15(2)11-14)24-22(26)17(13-23)12-19-8-10-21(29-19)16-4-6-18(7-5-16)25(27)28/h3-12H,1-2H3,(H,24,26)/b17-12+
InChIKey
YCPQPSQKNPKAJH-SFQUDFHCSA-N
Synonyms
868154-45-4
(2E)2cyanoN(24dimethylphenyl)3(5(4nitrophenyl)furan2yl)prop2enamide
(E)2CYANON(24DIMETHYLPHENYL)3(5(4NITROPHENYL)FURAN2YL)PROP2ENAMIDE
868154454
CC1=CC(=C(C=C1)NC(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)(N+)(=O)(O))C#N)C
InChI=1SC22H17N3O4c1143920(15(2)1114)2422(26)17(1323)121981021(2919)164618(7516)25(27)28h312H12H3(H2426)b1712+
MFCD06087902
N#CC(=Cc1ccc(o1)c1ccc(cc1)(N+)(=O)(O))C(=O)Nc1ccc(cc1C)C
ZINC000002708450
ZINC02708450
ZINC2708450

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Available files

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