Vitas-M small molecule compound
(5E)-2-amino-5-[4-(2,4-dinitrophenoxy)-3-methoxybenzylidene]-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
Catalog ID
STK177116
SMILES COc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C=C/1\C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)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 C26H18N6O6 MW 510.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18N6O6/c1-13-17(24-14(2)19(12-28)26(29)30-25(24)18(13)11-27)8-15-4-6-22(23(9-15)37-3)38-21-7-5-16(31(33)34)10-20(21)32(35)36/h4-10H,1-3H3,(H2,29,30)/b17-8+InChIKey
LFAORHPBEVPQJJ-CAOOACKPSA-NSynonyms
(5E)2AMINO5((4(24DINITROPHENOXY)3METHOXYPHENYL)METHYLIDENE)46DIMETHYLCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
(5E)2AMINO5(4(24DINITROPHENOXY)3METHOXYBENZYLIDENE)46DIMETHYL5HCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
(Z)2amino5(4(24dinitrophenoxy)3methoxybenzylidene)46dimethyl5Hcyclopenta(b)pyridine37dicarbonitrile
CC1=C(C2=C(C1=CC3=CC(=C(C=C3)OC4=C(C=C(C=C4)(N+)(=O)(O))(N+)(=O)(O))OC)C(=C(C(=N2)N)C#N)C)C#N
COc1cc(ccc1Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))C=C1C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)C
InChI=1SC26H18N6O6c11317(2414(2)19(1228)26(29)3025(24)18(13)1127)8154622(23(915)373)38217516(31(33)34)1020(21)32(35)36h410H13H3(H22930)b178+
MFCD02194295
ZINC000018272179
ZINC18272179
Check stock
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Check stock on Vitas-MAvailable files
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