2-(7-cyanobenzimidazol-1-yl)-N-[[4-(2-cyanopropan-2-yl)-3-fluoranyl-phenyl]methyl]ethanamide

Systemtic Name: 2-(7-cyanobenzimidazol-1-yl)-N-[[4-(2-cyanopropan-2-yl)-3-fluoranyl-phenyl]methyl]ethanamide Openeye Name: 2-(7-cyanobenzimidazol-1-yl)-N-[[4-(1-cyano-1-methyl-ethyl)-3-fluoro-phenyl]methyl]acetamide CAS Name: 2-(7-cyano-1-benzimidazolyl)-N-[[4-(2-cyanopropan-2-yl)-3-fluorophenyl]methyl]acetamide IUPAC Name: 2-(7-cyanobenzimidazol-1-yl)-N-[[4-(2-cyanopropan-2-yl)-3-fluorophenyl]methyl]acetamide Traditional Name: 2-(7-cyanobenzimidazol-1-yl)-N-[4-(1-cyano-1-methyl-ethyl)-3-fluoro-benzyl]acetamide Formula: C21H18FN5O MolecularWeight: 375.398923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=C(C=C(C=C1)CNC(=O)CN2C=NC3=CC=CC(=C32)C#N)F

Isomeric SMILES

CC(C)(C#N)C1=C(C=C(C=C1)CNC(=O)CN2C=NC3=CC=CC(=C32)C#N)F

InChI

InChI=1S/C21H18FN5O/c1-21(2,12-24)16-7-6-14(8-17(16)22)10-25-19(28)11-27-13-26-18-5-3-4-15(9-23)20(18)27/h3-8,13H,10-11H2,1-2H3,(H,25,28)