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

Systemtic Name: 3-acetamido-N-(4-azanylcyclohexyl)-4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]benzamide Openeye Name: 3-acetamido-N-(4-aminocyclohexyl)-4-[4-(4-fluorobenzoyl)piperazin-1-yl]benzamide CAS Name: 3-acetamido-N-(4-aminocyclohexyl)-4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]benzamide IUPAC Name: 3-acetamido-N-(4-aminocyclohexyl)-4-[4-(4-fluorobenzoyl)piperazin-1-yl]benzamide Traditional Name: 3-acetamido-N-(4-aminocyclohexyl)-4-[4-(4-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=C(C=C4)F

Isomeric SMILES

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

InChI

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