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

Systemtic Name: N-(4-azanylcyclohexyl)-1-ethanoyl-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[benzyl(2-thienylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[benzyl(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[benzyl(2-thenyl)amino]pyrrolidine-2-carboxamide Formula: C25H34N4O2S MolecularWeight: 454.62806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34N4O2S/c1-18(30)29-16-22(14-24(29)25(31)27-21-11-9-20(26)10-12-21)28(17-23-8-5-13-32-23)15-19-6-3-2-4-7-19/h2-8,13,20-22,24H,9-12,14-17,26H2,1H3,(H,27,31)