N-ethyl-2-[4-[2-fluoranyl-4-(2-pyridin-4-ylethanoylamino)phenyl]piperazin-1-yl]-2-phenyl-ethanamide

Systemtic Name: N-ethyl-2-[4-[2-fluoranyl-4-(2-pyridin-4-ylethanoylamino)phenyl]piperazin-1-yl]-2-phenyl-ethanamide Openeye Name: N-ethyl-2-[4-[2-fluoro-4-[[2-(4-pyridyl)acetyl]amino]phenyl]piperazin-1-yl]-2-phenyl-acetamide CAS Name: N-ethyl-2-[4-[2-fluoro-4-[(1-oxo-2-pyridin-4-ylethyl)amino]phenyl]-1-piperazinyl]-2-phenylacetamide IUPAC Name: N-ethyl-2-[4-[2-fluoro-4-[(2-pyridin-4-ylacetyl)amino]phenyl]piperazin-1-yl]-2-phenylacetamide Traditional Name: N-ethyl-2-[4-[2-fluoro-4-[[2-(4-pyridyl)acetyl]amino]phenyl]piperazino]-2-phenyl-acetamide Formula: C27H30FN5O2 MolecularWeight: 475.557803

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)CC4=CC=NC=C4)F

Isomeric SMILES

CCNC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)CC4=CC=NC=C4)F

InChI

InChI=1S/C27H30FN5O2/c1-2-30-27(35)26(21-6-4-3-5-7-21)33-16-14-32(15-17-33)24-9-8-22(19-23(24)28)31-25(34)18-20-10-12-29-13-11-20/h3-13,19,26H,2,14-18H2,1H3,(H,30,35)(H,31,34)