Vitas-M small molecule compound

2-{4-[(Z)-(2-amino-3,7-dicyano-4,6-dimethyl-5H-cyclopenta[b]pyridin-5-ylidene)methyl]-2-chlorophenoxy}-N-phenylacetamide

Catalog ID
STK074524
SMILES N#CC1=C(C)/C(=C/c2ccc(c(c2)Cl)OCC(=O)Nc2ccccc2)/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 C27H20ClN5O2 MW 481.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN5O2/c1-15-19(25-16(2)21(13-30)27(31)33-26(25)20(15)12-29)10-17-8-9-23(22(28)11-17)35-14-24(34)32-18-6-4-3-5-7-18/h3-11H,14H2,1-2H3,(H2,31,33)(H,32,34)/b19-10-
InChIKey
HIGUANYDBXBZDX-GRSHGNNSSA-N
Synonyms
573970-83-9
(Z)2(4((2amino37dicyano46dimethyl5Hcyclopenta(b)pyridin5ylidene)methyl)2chlorophenoxy)Nphenylacetamide
2(4((2AMINO37DICYANO46DIMETHYL5HCYCLOPENTA(B)PYRIDIN5YLIDENE)METHYL)2CHLOROPHENOXY)NPHENYLACETAMIDE
2(4((Z)(2AMINO37DICYANO46DIMETHYL5HCYCLOPENTA(B)PYRIDIN5YLIDENE)METHYL)2CHLOROPHENOXY)NPHENYLACETAMIDE
2(4((Z)(2AMINO37DICYANO46DIMETHYLCYCLOPENTA(B)PYRIDIN5YLIDENE)METHYL)2CHLOROPHENOXY)NPHENYLACETAMIDE
573970839
CC1=C(C2=C(C1=CC3=CC(=C(C=C3)OCC(=O)NC4=CC=CC=C4)Cl)C(=C(C(=N2)N)C#N)C)C#N
InChI=1SC27H20ClN5O2c11519(2516(2)21(1330)27(31)3326(25)20(15)1229)10178923(22(28)1117)351424(34)32186435718h311H14H212H3(H23133)(H3234)b1910
MFCD03700042
N#CC1=C(C)C(=Cc2ccc(c(c2)Cl)OCC(=O)Nc2ccccc2)c2c1nc(N)c(c2C)C#N
STK074524
ZINC000101066463
ZINC101066463

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Available files

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