2-[2-[4-(2-cyano-3-fluoranyl-phenyl)piperazin-1-yl]ethanoylamino]-N-propan-2-yl-benzamide

Systemtic Name: 2-[2-[4-(2-cyano-3-fluoranyl-phenyl)piperazin-1-yl]ethanoylamino]-N-propan-2-yl-benzamide Openeye Name: 2-[[2-[4-(2-cyano-3-fluoro-phenyl)piperazin-1-yl]acetyl]amino]-N-isopropyl-benzamide CAS Name: 2-[[2-[4-(2-cyano-3-fluorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 2-[[2-[4-(2-cyano-3-fluorophenyl)piperazin-1-yl]acetyl]amino]-N-propan-2-ylbenzamide Traditional Name: 2-[[2-[4-(2-cyano-3-fluoro-phenyl)piperazino]acetyl]amino]-N-isopropyl-benzamide Formula: C23H26FN5O2 MolecularWeight: 423.483243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=CC=C1NC(=O)CN2CCN(CC2)C3=C(C(=CC=C3)F)C#N

Isomeric SMILES

CC(C)NC(=O)C1=CC=CC=C1NC(=O)CN2CCN(CC2)C3=C(C(=CC=C3)F)C#N

InChI

InChI=1S/C23H26FN5O2/c1-16(2)26-23(31)17-6-3-4-8-20(17)27-22(30)15-28-10-12-29(13-11-28)21-9-5-7-19(24)18(21)14-25/h3-9,16H,10-13,15H2,1-2H3,(H,26,31)(H,27,30)