2-[4-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-[(2S)-2-phenylpropyl]ethanamide

Systemtic Name: 2-[4-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-[(2S)-2-phenylpropyl]ethanamide Openeye Name: 2-[4-[2-(3-fluoroanilino)-2-oxo-ethyl]piperazin-1-yl]-N-[(2S)-2-phenylpropyl]acetamide CAS Name: 2-[4-[2-(3-fluoroanilino)-2-oxoethyl]-1-piperazinyl]-N-[(2S)-2-phenylpropyl]acetamide IUPAC Name: 2-[4-[2-(3-fluoroanilino)-2-oxoethyl]piperazin-1-yl]-N-[(2S)-2-phenylpropyl]acetamide Traditional Name: 2-[4-[2-(3-fluoroanilino)-2-keto-ethyl]piperazino]-N-[(2S)-2-phenylpropyl]acetamide Formula: C23H29FN4O2 MolecularWeight: 412.500363

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CN1CCN(CC1)CC(=O)NC2=CC(=CC=C2)F)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)CN1CCN(CC1)CC(=O)NC2=CC(=CC=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C23H29FN4O2/c1-18(19-6-3-2-4-7-19)15-25-22(29)16-27-10-12-28(13-11-27)17-23(30)26-21-9-5-8-20(24)14-21/h2-9,14,18H,10-13,15-17H2,1H3,(H,25,29)(H,26,30)/t18-/m1/s1