N-[[3-(aminomethyl)cyclohexyl]methyl]-1-(4-fluorophenyl)carbonyl-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-(4-fluorophenyl)carbonyl-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-(4-fluorobenzoyl)-4-[isobutyl(p-tolylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-[(4-fluorophenyl)-oxomethyl]-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-(4-fluorobenzoyl)-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]pyrrolidine-2-carboxamide Traditional Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-(4-fluorobenzoyl)-4-[isobutyl-(4-methylbenzyl)amino]pyrrolidine-2-carboxamide Formula: C32H45FN4O2 MolecularWeight: 536.723703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC(C)C)C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCC4CCCC(C4)CN

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC(C)C)C2CC(N(C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCC4CCCC(C4)CN

InChI

InChI=1S/C32H45FN4O2/c1-22(2)19-36(20-24-9-7-23(3)8-10-24)29-16-30(31(38)35-18-26-6-4-5-25(15-26)17-34)37(21-29)32(39)27-11-13-28(33)14-12-27/h7-14,22,25-26,29-30H,4-6,15-21,34H2,1-3H3,(H,35,38)