N-[[3-(aminomethyl)cyclohexyl]methyl]-1-cyclopropylcarbonyl-4-[phenethyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-cyclopropylcarbonyl-4-[phenethyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(phenethyl)amino]-1-(cyclopropanecarbonyl)pyrrolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-[cyclopropyl(oxo)methyl]-4-[phenethyl-(phenylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(phenethyl)amino]-1-(cyclopropanecarbonyl)pyrrolidine-2-carboxamide Traditional Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(phenethyl)amino]-1-(cyclopropanecarbonyl)pyrrolidine-2-carboxamide Formula: C32H44N4O2 MolecularWeight: 516.71736

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CNC(=O)C2CC(CN2C(=O)C3CC3)N(CCC4=CC=CC=C4)CC5=CC=CC=C5)CN

Isomeric SMILES

C1CC(CC(C1)CNC(=O)C2CC(CN2C(=O)C3CC3)N(CCC4=CC=CC=C4)CC5=CC=CC=C5)CN

InChI

InChI=1S/C32H44N4O2/c33-20-26-12-7-13-27(18-26)21-34-31(37)30-19-29(23-36(30)32(38)28-14-15-28)35(22-25-10-5-2-6-11-25)17-16-24-8-3-1-4-9-24/h1-6,8-11,26-30H,7,12-23,33H2,(H,34,37)