(2S)-N-(3-fluoranyl-4-methyl-phenyl)-2-[4-(phenylcarbonyl)piperazin-1-yl]propanamide

Systemtic Name: (2S)-N-(3-fluoranyl-4-methyl-phenyl)-2-[4-(phenylcarbonyl)piperazin-1-yl]propanamide Openeye Name: (2S)-2-(4-benzoylpiperazin-1-yl)-N-(3-fluoro-4-methyl-phenyl)propanamide CAS Name: (2S)-2-(4-benzoyl-1-piperazinyl)-N-(3-fluoro-4-methylphenyl)propanamide IUPAC Name: (2S)-2-(4-benzoylpiperazin-1-yl)-N-(3-fluoro-4-methylphenyl)propanamide Traditional Name: (2S)-2-(4-benzoylpiperazino)-N-(3-fluoro-4-methyl-phenyl)propionamide Formula: C21H24FN3O2 MolecularWeight: 369.432563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24FN3O2/c1-15-8-9-18(14-19(15)22)23-20(26)16(2)24-10-12-25(13-11-24)21(27)17-6-4-3-5-7-17/h3-9,14,16H,10-13H2,1-2H3,(H,23,26)/t16-/m0/s1