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

Systemtic Name: N-(4-azanylcyclohexyl)-1-ethanoyl-4-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[(4-fluorobenzyl)-(2-thenyl)amino]pyrrolidine-2-carboxamide Formula: C25H33FN4O2S MolecularWeight: 472.618523

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)NC2CCC(CC2)N)N(CC3=CC=C(C=C3)F)CC4=CC=CS4

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)NC2CCC(CC2)N)N(CC3=CC=C(C=C3)F)CC4=CC=CS4

InChI

InChI=1S/C25H33FN4O2S/c1-17(31)30-15-22(13-24(30)25(32)28-21-10-8-20(27)9-11-21)29(16-23-3-2-12-33-23)14-18-4-6-19(26)7-5-18/h2-7,12,20-22,24H,8-11,13-16,27H2,1H3,(H,28,32)