N-[(3-cyanonaphthalen-1-yl)methyl]-2-(4-fluorophenyl)-N-methyl-2-piperazin-1-yl-ethanamide

Systemtic Name: N-[(3-cyanonaphthalen-1-yl)methyl]-2-(4-fluorophenyl)-N-methyl-2-piperazin-1-yl-ethanamide Openeye Name: N-[(3-cyano-1-naphthyl)methyl]-2-(4-fluorophenyl)-N-methyl-2-piperazin-1-yl-acetamide CAS Name: N-[(3-cyano-1-naphthalenyl)methyl]-2-(4-fluorophenyl)-N-methyl-2-(1-piperazinyl)acetamide IUPAC Name: N-[(3-cyanonaphthalen-1-yl)methyl]-2-(4-fluorophenyl)-N-methyl-2-piperazin-1-ylacetamide Traditional Name: N-[(3-cyano-1-naphthyl)methyl]-2-(4-fluorophenyl)-N-methyl-2-piperazino-acetamide Formula: C25H25FN4O MolecularWeight: 416.490603

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC2=CC=CC=C21)C#N)C(=O)C(C3=CC=C(C=C3)F)N4CCNCC4

Isomeric SMILES

CN(CC1=CC(=CC2=CC=CC=C21)C#N)C(=O)C(C3=CC=C(C=C3)F)N4CCNCC4

InChI

InChI=1S/C25H25FN4O/c1-29(17-21-15-18(16-27)14-20-4-2-3-5-23(20)21)25(31)24(30-12-10-28-11-13-30)19-6-8-22(26)9-7-19/h2-9,14-15,24,28H,10-13,17H2,1H3