N-(4-azanylcyclohexyl)-4-[cyclopropyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[cyclopropyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[benzyl(cyclopropyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-(phenylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[benzyl(cyclopropyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[benzyl(cyclopropyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C27H35N5O2 MolecularWeight: 461.5991

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2CC(CN2C(=O)C3=CN=CC=C3)N(CC4=CC=CC=C4)C5CC5

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2CC(CN2C(=O)C3=CN=CC=C3)N(CC4=CC=CC=C4)C5CC5

InChI

InChI=1S/C27H35N5O2/c28-21-8-10-22(11-9-21)30-26(33)25-15-24(18-32(25)27(34)20-7-4-14-29-16-20)31(23-12-13-23)17-19-5-2-1-3-6-19/h1-7,14,16,21-25H,8-13,15,17-18,28H2,(H,30,33)