CCOC(=O)C(C)(C(C)=O)c1ccc2nc(Nc3ccc(F)cc3C)n(C)c2c1C#N
Name: 2-[4-cyano-2-(4-fluoro-2-methyl-phenylamino)-3-methyl-3H-benzoimidazol-5-yl]-2-methyl-3-oxo-butyric acid ethyl ester
IUPAC: ethyl 2-[4-cyano-2-(4-fluoro-2-methylanilino)-3-methylbenzimidazol-5-yl]-2-methyl-3-oxobutanoate
SMILES: CCOC(=O)C(C)(C(C)=O)c1ccc2nc(Nc3ccc(F)cc3C)n(C)c2c1C#N
Canonical SMILES: CCOC(=O)C(C)(C1=C(C2=C(C=C1)N=C(N2C)NC3=C(C=C(C=C3)F)C)C#N)C(=O)C
Summenformel: C23H23FN4O3
Molare Masse: 422.50
InChIKey: AQKATBKTGOOGQP-UHFFFAOYSA-N
InChI: InChI=1S/C23H23FN4O3/c1-6-31-21(30)23(4,14(3)29)17-8-10-19-20(16(17)12-25)28(5)22(27-19)26-18-9-7-15(24)11-13(18)2/h7-11H,6H2,1-5H3,(H,26,27)
PubChem CID: 66832324

Synonyme

SCHEMBL893401AQKATBKTGOOGQP-UHFFFAOYSA-N2-[4-cyano-2-(4-fluoro-2-methyl-phenylamino)-3-methyl-3H-benzoimidazol-5-yl]-2-methyl-3-oxo-butyric acid ethyl ester