N-(4-azanylcyclohexyl)-3-benzamido-4-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-benzamido-4-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]benzamide Openeye Name: N-(4-aminocyclohexyl)-3-benzamido-4-[4-(3-fluorobenzoyl)piperazin-1-yl]benzamide CAS Name: N-(4-aminocyclohexyl)-3-benzamido-4-[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-benzamido-4-[4-(3-fluorobenzoyl)piperazin-1-yl]benzamide Traditional Name: N-(4-aminocyclohexyl)-3-benzamido-4-[4-(3-fluorobenzoyl)piperazino]benzamide Formula: C31H34FN5O3 MolecularWeight: 543.631763

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)F)NC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)F)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H34FN5O3/c32-24-8-4-7-23(19-24)31(40)37-17-15-36(16-18-37)28-14-9-22(30(39)34-26-12-10-25(33)11-13-26)20-27(28)35-29(38)21-5-2-1-3-6-21/h1-9,14,19-20,25-26H,10-13,15-18,33H2,(H,34,39)(H,35,38)