Vitas-M small molecule compound
(2E)-2-cyano-N-(2-methoxy-5-nitrophenyl)-3-(pyridin-3-yl)prop-2-enamide
Catalog ID
STK081699
SMILES N#C/C(=C\c1cccnc1)/C(=O)Nc1cc(ccc1OC)[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 C16H12N4O4 MW 324.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4O4/c1-24-15-5-4-13(20(22)23)8-14(15)19-16(21)12(9-17)7-11-3-2-6-18-10-11/h2-8,10H,1H3,(H,19,21)/b12-7+InChIKey
QXQQHOBXGSSWCZ-KPKJPENVSA-NSynonyms
404021-97-2(2E)2CYANON(2METHOXY5NITROPHENYL)3(PYRIDIN3YL)PROP2ENAMIDE
(E)2CYANON(2METHOXY5NITROPHENYL)3PYRIDIN3YLPROP2ENAMIDE
404021972
COC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)C(=CC2=CN=CC=C2)C#N
InChI=1SC16H12N4O4c124155413(20(22)23)814(15)1916(21)12(917)711326181011h2810H1H3(H1921)b127+
MFCD02605236
N#CC(=Cc1cccnc1)C(=O)Nc1cc(ccc1OC)(N+)(=O)(O)
STK081699
ZINC000000566158
ZINC00566158
ZINC566158
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