Vitas-M small molecule compound
(5Z)-2-amino-5-[4-(benzyloxy)-3,5-dibromobenzylidene]-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
Catalog ID
STK170306
SMILES N#CC1=C(C)/C(=C/c2cc(Br)c(c(c2)Br)OCc2ccccc2)/c2c1nc(N)c(c2C)C#N
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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 C26H18Br2N4O MW 562.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18Br2N4O/c1-14-18(23-15(2)20(12-30)26(31)32-24(23)19(14)11-29)8-17-9-21(27)25(22(28)10-17)33-13-16-6-4-3-5-7-16/h3-10H,13H2,1-2H3,(H2,31,32)/b18-8-InChIKey
MPXBQLHFJSFHPS-LSCVHKIXSA-NSynonyms
(5Z)2amino5((35dibromo4phenylmethoxyphenyl)methylidene)46dimethylcyclopenta(b)pyridine37dicarbonitrile
(5Z)2AMINO5(4(BENZYLOXY)35DIBROMOBENZYLIDENE)46DIMETHYL5HCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
2AMINO5((35DIBROMO4(PHENYLMETHOXY)PHENYL)METHYLENE)46DIMETHYLCYCLOPENTA(21B)PYRIDINE37DICARBONITRILE
CC1=C(C2=C(C1=CC3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4)Br)C(=C(C(=N2)N)C#N)C)C#N
InChI=1SC26H18Br2N4Oc11418(2315(2)20(1230)26(31)3224(23)19(14)1129)817921(27)25(22(28)1017)3313166435716h310H13H212H3(H23132)b188
MFCD01823473
N#CC1=C(C)C(=Cc2cc(Br)c(c(c2)Br)OCc2ccccc2)c2c1nc(N)c(c2C)C#N
ZINC000100195058
ZINC100195058
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