2-[4-[(5-cyano-2-fluoranyl-phenyl)methyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-[(5-cyano-2-fluoranyl-phenyl)methyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)ethanamide Openeye Name: 2-[4-[(5-cyano-2-fluoro-phenyl)methyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[4-[(5-cyano-2-fluorophenyl)methyl]-1-piperazinyl]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[4-[(5-cyano-2-fluorophenyl)methyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[4-(5-cyano-2-fluoro-benzyl)piperazino]-N-(2,3-dimethylphenyl)acetamide Formula: C22H25FN4O MolecularWeight: 380.458503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)CC3=C(C=CC(=C3)C#N)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)CC3=C(C=CC(=C3)C#N)F)C

InChI

InChI=1S/C22H25FN4O/c1-16-4-3-5-21(17(16)2)25-22(28)15-27-10-8-26(9-11-27)14-19-12-18(13-24)6-7-20(19)23/h3-7,12H,8-11,14-15H2,1-2H3,(H,25,28)