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

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-cyclopropylcarbonyl-4-[(2-methylphenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-(cyclopropanecarbonyl)-4-[o-tolylmethyl(phenethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-[cyclopropyl(oxo)methyl]-4-[(2-methylphenyl)methyl-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-(cyclopropanecarbonyl)-4-[(2-methylphenyl)methyl-phenethylamino]pyrrolidine-2-carboxamide Traditional Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-(cyclopropanecarbonyl)-4-[(2-methylbenzyl)-phenethyl-amino]pyrrolidine-2-carboxamide Formula: C33H46N4O2 MolecularWeight: 530.74394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4CC4)C(=O)NCC5CCCC(C5)CN

Isomeric SMILES

CC1=CC=CC=C1CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4CC4)C(=O)NCC5CCCC(C5)CN

InChI

InChI=1S/C33H46N4O2/c1-24-8-5-6-13-29(24)22-36(17-16-25-9-3-2-4-10-25)30-19-31(37(23-30)33(39)28-14-15-28)32(38)35-21-27-12-7-11-26(18-27)20-34/h2-6,8-10,13,26-28,30-31H,7,11-12,14-23,34H2,1H3,(H,35,38)