Vitas-M small molecule compound
(5Z)-2-amino-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
Catalog ID
STK169483
SMILES CCOc1cc2OCOc2cc1/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 C22H18N4O3 MW 386.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O3/c1-4-27-17-7-19-18(28-10-29-19)6-13(17)5-14-11(2)15(8-23)21-20(14)12(3)16(9-24)22(25)26-21/h5-7H,4,10H2,1-3H3,(H2,25,26)/b14-5-InChIKey
KOPLNRUZENNVSC-RZNTYIFUSA-NSynonyms
(5Z)2AMINO5((6ETHOXY13BENZODIOXOL5YL)METHYLIDENE)46DIMETHYL5HCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
(5Z)2AMINO5((6ETHOXY13BENZODIOXOL5YL)METHYLIDENE)46DIMETHYLCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
(E)2amino5((6ethoxybenzo(d)(13)dioxol5yl)methylene)46dimethyl5Hcyclopenta(b)pyridine37dicarbonitrile
2AMINO5((6ETHOXY13BENZODIOXOL5YL)METHYLENE)46DIMETHYL5HCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
CCOC1=CC2=C(C=C1C=C3C(=C(C4=C3C(=C(C(=N4)N)C#N)C)C#N)C)OCO2
CCOc1cc2OCOc2cc1C=C1C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)C
InChI=1SC22H18N4O3c14271771918(28102919)613(17)51411(2)15(823)2120(14)12(3)16(924)22(25)2621h57H410H213H3(H22526)b145
MFCD05741263
ZINC000101675864
ZINC101675864
Check stock
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Check stock on Vitas-MAvailable files
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