N-[1-(4-cyano-3-fluoranyl-phenyl)-1-(3-methylimidazol-4-yl)ethyl]-3-(3-hydroxyphenyl)propanamide

Systemtic Name: N-[1-(4-cyano-3-fluoranyl-phenyl)-1-(3-methylimidazol-4-yl)ethyl]-3-(3-hydroxyphenyl)propanamide Openeye Name: N-[1-(4-cyano-3-fluoro-phenyl)-1-(3-methylimidazol-4-yl)ethyl]-3-(3-hydroxyphenyl)propanamide CAS Name: N-[1-(4-cyano-3-fluorophenyl)-1-(3-methyl-4-imidazolyl)ethyl]-3-(3-hydroxyphenyl)propanamide IUPAC Name: N-[1-(4-cyano-3-fluorophenyl)-1-(3-methylimidazol-4-yl)ethyl]-3-(3-hydroxyphenyl)propanamide Traditional Name: N-[1-(4-cyano-3-fluoro-phenyl)-1-(3-methylimidazol-4-yl)ethyl]-3-(3-hydroxyphenyl)propionamide Formula: C22H21FN4O2 MolecularWeight: 392.426143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C#N)F)(C2=CN=CN2C)NC(=O)CCC3=CC(=CC=C3)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)C#N)F)(C2=CN=CN2C)NC(=O)CCC3=CC(=CC=C3)O

InChI

InChI=1S/C22H21FN4O2/c1-22(20-13-25-14-27(20)2,17-8-7-16(12-24)19(23)11-17)26-21(29)9-6-15-4-3-5-18(28)10-15/h3-5,7-8,10-11,13-14,28H,6,9H2,1-2H3,(H,26,29)