4-[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]-N-(4-methylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]-N-(4-methylphenyl)piperazine-1-carboxamide Openeye Name: 4-[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]-N-(p-tolyl)piperazine-1-carboxamide CAS Name: 4-[(2S)-2-acetamido-3-(4-fluorophenyl)-1-oxopropyl]-N-(4-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]-N-(4-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]-N-(p-tolyl)piperazine-1-carboxamide Formula: C23H27FN4O3 MolecularWeight: 426.483883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C(=O)C(CC3=CC=C(C=C3)F)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C(=O)[C@H](CC3=CC=C(C=C3)F)NC(=O)C

InChI

InChI=1S/C23H27FN4O3/c1-16-3-9-20(10-4-16)26-23(31)28-13-11-27(12-14-28)22(30)21(25-17(2)29)15-18-5-7-19(24)8-6-18/h3-10,21H,11-15H2,1-2H3,(H,25,29)(H,26,31)/t21-/m0/s1