N-(2-azanylethyl)-4-[(4-fluorophenyl)methyl-phenethyl-amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[(4-fluorophenyl)methyl-phenethyl-amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[(4-fluorophenyl)methyl-phenethyl-amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[(4-fluorophenyl)methyl-phenethylamino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[(4-fluorophenyl)methyl-phenethylamino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[(4-fluorobenzyl)-phenethyl-amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C28H32FN5O2 MolecularWeight: 489.584383

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)NCCN)C(=O)C2=CN=CC=C2)N(CCC3=CC=CC=C3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1C(CN(C1C(=O)NCCN)C(=O)C2=CN=CC=C2)N(CCC3=CC=CC=C3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C28H32FN5O2/c29-24-10-8-22(9-11-24)19-33(16-12-21-5-2-1-3-6-21)25-17-26(27(35)32-15-13-30)34(20-25)28(36)23-7-4-14-31-18-23/h1-11,14,18,25-26H,12-13,15-17,19-20,30H2,(H,32,35)