N-[4-[3-cyano-6-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-methyl-hexan-3-yl]phenyl]ethanamide

Systemtic Name: N-[4-[3-cyano-6-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-methyl-hexan-3-yl]phenyl]ethanamide Openeye Name: N-[4-[1-cyano-4-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-1-isopropyl-butyl]phenyl]acetamide CAS Name: N-[4-[3-cyano-6-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]-2-methylhexan-3-yl]phenyl]acetamide IUPAC Name: N-[4-[3-cyano-6-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-methylhexan-3-yl]phenyl]acetamide Traditional Name: N-[4-[1-cyano-4-[4-[2-(4-fluorophenoxy)ethyl]piperazino]-1-isopropyl-butyl]phenyl]acetamide Formula: C28H37FN4O2 MolecularWeight: 480.617383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=C(C=C2)F)(C#N)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=C(C=C2)F)(C#N)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C28H37FN4O2/c1-22(2)28(21-30,24-5-9-26(10-6-24)31-23(3)34)13-4-14-32-15-17-33(18-16-32)19-20-35-27-11-7-25(29)8-12-27/h5-12,22H,4,13-20H2,1-3H3,(H,31,34)