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

Systemtic Name: 3-acetamido-N-(4-azanylcyclohexyl)-4-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]benzamide Openeye Name: 3-acetamido-N-(4-aminocyclohexyl)-4-[4-(3-fluorobenzoyl)piperazin-1-yl]benzamide CAS Name: 3-acetamido-N-(4-aminocyclohexyl)-4-[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]benzamide IUPAC Name: 3-acetamido-N-(4-aminocyclohexyl)-4-[4-(3-fluorobenzoyl)piperazin-1-yl]benzamide Traditional Name: 3-acetamido-N-(4-aminocyclohexyl)-4-[4-(3-fluorobenzoyl)piperazino]benzamide Formula: C26H32FN5O3 MolecularWeight: 481.562383

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)N)N3CCN(CC3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)N)N3CCN(CC3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C26H32FN5O3/c1-17(33)29-23-16-18(25(34)30-22-8-6-21(28)7-9-22)5-10-24(23)31-11-13-32(14-12-31)26(35)19-3-2-4-20(27)15-19/h2-5,10,15-16,21-22H,6-9,11-14,28H2,1H3,(H,29,33)(H,30,34)