N-(2-azanylethyl)-1-(4-fluorophenyl)carbonyl-4-[2-methylpropanoyl(phenethyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(4-fluorophenyl)carbonyl-4-[2-methylpropanoyl(phenethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(4-fluorobenzoyl)-4-[2-methylpropanoyl(phenethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(4-fluorophenyl)-oxomethyl]-4-[(2-methyl-1-oxopropyl)-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(4-fluorobenzoyl)-4-[2-methylpropanoyl(phenethyl)amino]pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(4-fluorobenzoyl)-4-[isobutyryl(phenethyl)amino]pyrrolidine-2-carboxamide Formula: C26H33FN4O3 MolecularWeight: 468.563623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N(CCC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCCN

Isomeric SMILES

CC(C)C(=O)N(CCC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCCN

InChI

InChI=1S/C26H33FN4O3/c1-18(2)25(33)30(15-12-19-6-4-3-5-7-19)22-16-23(24(32)29-14-13-28)31(17-22)26(34)20-8-10-21(27)11-9-20/h3-11,18,22-23H,12-17,28H2,1-2H3,(H,29,32)