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

Systemtic Name: N-(4-azanylcyclohexyl)-4-[(4-fluorophenyl)methyl-phenethyl-amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[(4-fluorophenyl)methyl-phenethyl-amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[(4-fluorophenyl)methyl-phenethylamino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[(4-fluorophenyl)methyl-phenethylamino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[(4-fluorobenzyl)-phenethyl-amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C34H41FN4O2 MolecularWeight: 556.713343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NC3CCC(CC3)N)N(CCC4=CC=CC=C4)CC5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NC3CCC(CC3)N)N(CCC4=CC=CC=C4)CC5=CC=C(C=C5)F

InChI

InChI=1S/C34H41FN4O2/c1-24-7-11-27(12-8-24)34(41)39-23-31(21-32(39)33(40)37-30-17-15-29(36)16-18-30)38(20-19-25-5-3-2-4-6-25)22-26-9-13-28(35)14-10-26/h2-14,29-32H,15-23,36H2,1H3,(H,37,40)