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

Systemtic Name: N-(4-azanylcyclohexyl)-4-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[(4-fluorobenzyl)-(2-thenyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C29H34FN5O2S MolecularWeight: 535.675963

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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)CC5=CC=CS5

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2CC(CN2C(=O)C3=CN=CC=C3)N(CC4=CC=C(C=C4)F)CC5=CC=CS5

InChI

InChI=1S/C29H34FN5O2S/c30-22-7-5-20(6-8-22)17-34(19-26-4-2-14-38-26)25-15-27(28(36)33-24-11-9-23(31)10-12-24)35(18-25)29(37)21-3-1-13-32-16-21/h1-8,13-14,16,23-25,27H,9-12,15,17-19,31H2,(H,33,36)