N-(4-azanylcyclohexyl)-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[isobutyl(o-tolylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[isobutyl-(2-methylbenzyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C29H41N5O2 MolecularWeight: 491.66814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC(C)C)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NC4CCC(CC4)N

Isomeric SMILES

CC1=CC=CC=C1CN(CC(C)C)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NC4CCC(CC4)N

InChI

InChI=1S/C29H41N5O2/c1-20(2)17-33(18-23-8-5-4-7-21(23)3)26-15-27(28(35)32-25-12-10-24(30)11-13-25)34(19-26)29(36)22-9-6-14-31-16-22/h4-9,14,16,20,24-27H,10-13,15,17-19,30H2,1-3H3,(H,32,35)