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

Systemtic Name: N-(4-azanylcyclohexyl)-4-[cyclopropyl-[(4-fluorophenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-[(4-fluorophenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-[(4-fluorophenyl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-[(4-fluorophenyl)methyl]amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-(4-fluorobenzyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C27H34FN5O2 MolecularWeight: 479.589563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34FN5O2/c28-20-5-3-18(4-6-20)16-32(23-11-12-23)24-14-25(26(34)31-22-9-7-21(29)8-10-22)33(17-24)27(35)19-2-1-13-30-15-19/h1-6,13,15,21-25H,7-12,14,16-17,29H2,(H,31,34)