4-cyano-2-fluoranyl-N-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide

Systemtic Name: 4-cyano-2-fluoranyl-N-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide Openeye Name: 4-cyano-2-fluoro-N-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 4-cyano-2-fluoro-N-[4-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-cyano-2-fluoro-N-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 4-cyano-2-fluoro-N-[4-(4-isobutyrylpiperazino)phenyl]benzamide Formula: C22H23FN4O2 MolecularWeight: 394.442023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C22H23FN4O2/c1-15(2)22(29)27-11-9-26(10-12-27)18-6-4-17(5-7-18)25-21(28)19-8-3-16(14-24)13-20(19)23/h3-8,13,15H,9-12H2,1-2H3,(H,25,28)