N-[3-[4-(2-cyanophenyl)piperazin-1-yl]propyl]-2-(4-fluoranyl-3-methyl-phenyl)-3-methyl-butanamide

Systemtic Name: N-[3-[4-(2-cyanophenyl)piperazin-1-yl]propyl]-2-(4-fluoranyl-3-methyl-phenyl)-3-methyl-butanamide Openeye Name: N-[3-[4-(2-cyanophenyl)piperazin-1-yl]propyl]-2-(4-fluoro-3-methyl-phenyl)-3-methyl-butanamide CAS Name: N-[3-[4-(2-cyanophenyl)-1-piperazinyl]propyl]-2-(4-fluoro-3-methylphenyl)-3-methylbutanamide IUPAC Name: N-[3-[4-(2-cyanophenyl)piperazin-1-yl]propyl]-2-(4-fluoro-3-methylphenyl)-3-methylbutanamide Traditional Name: N-[3-[4-(2-cyanophenyl)piperazino]propyl]-2-(4-fluoro-3-methyl-phenyl)-3-methyl-butyramide Formula: C26H33FN4O MolecularWeight: 436.564823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C(C)C)C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3C#N)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(C(C)C)C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3C#N)F

InChI

InChI=1S/C26H33FN4O/c1-19(2)25(21-9-10-23(27)20(3)17-21)26(32)29-11-6-12-30-13-15-31(16-14-30)24-8-5-4-7-22(24)18-28/h4-5,7-10,17,19,25H,6,11-16H2,1-3H3,(H,29,32)