Vitas-M small molecule compound

(5Z)-2-amino-5-(3-fluorobenzylidene)-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile

Catalog ID
STK089620
SMILES N#CC1=C(C)/C(=C/c2cccc(c2)F)/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 C19H13FN4 MW 316.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13FN4/c1-10-14(7-12-4-3-5-13(20)6-12)17-11(2)16(9-22)19(23)24-18(17)15(10)8-21/h3-7H,1-2H3,(H2,23,24)/b14-7-
InChIKey
JJDLOQIHVUFKKT-AUWJEWJLSA-N
Synonyms

(5Z)2AMINO5((3FLUOROPHENYL)METHYLIDENE)46DIMETHYLCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
(5Z)2AMINO5(3FLUOROBENZYLIDENE)46DIMETHYL5HCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
(E)2amino5(3fluorobenzylidene)46dimethyl5Hcyclopenta(b)pyridine37dicarbonitrile
2AMINO5(3FLUOROBENZYLIDENE)46DIMETHYL5HCYCLOPENTA(B)PYRIDINE37DICARBONITRILE
CC1=C(C2=C(C1=CC3=CC(=CC=C3)F)C(=C(C(=N2)N)C#N)C)C#N
InChI=1SC19H13FN4c11014(71243513(20)612)1711(2)16(922)19(23)2418(17)15(10)821h37H12H3(H22324)b147
MFCD03700017
N#CC1=C(C)C(=Cc2cccc(c2)F)c2c1nc(N)c(c2C)C#N
STK089620
ZINC000100989042
ZINC100989042

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.