N-(4-azanylcyclohexyl)-1-(4-fluorophenyl)carbonyl-4-[(4-methoxyphenyl)carbonyl-phenethyl-amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(4-fluorophenyl)carbonyl-4-[(4-methoxyphenyl)carbonyl-phenethyl-amino]pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(4-fluorobenzoyl)-4-[(4-methoxybenzoyl)-phenethyl-amino]pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(4-fluorophenyl)-oxomethyl]-4-[[(4-methoxyphenyl)-oxomethyl]-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(4-fluorobenzoyl)-4-[(4-methoxybenzoyl)-phenethylamino]pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(4-fluorobenzoyl)-4-[p-anisoyl(phenethyl)amino]pyrrolidine-2-carboxamide Formula: C34H39FN4O4 MolecularWeight: 586.696263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NC5CCC(CC5)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C34H39FN4O4/c1-43-30-17-9-25(10-18-30)33(41)38(20-19-23-5-3-2-4-6-23)29-21-31(32(40)37-28-15-13-27(36)14-16-28)39(22-29)34(42)24-7-11-26(35)12-8-24/h2-12,17-18,27-29,31H,13-16,19-22,36H2,1H3,(H,37,40)