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

Systemtic Name: N-(4-azanylcyclohexyl)-4-[cyclopropyl-(phenylmethyl)amino]-1-(3-methoxyphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[benzyl(cyclopropyl)amino]-1-(3-methoxybenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-(phenylmethyl)amino]-1-[(3-methoxyphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[benzyl(cyclopropyl)amino]-1-(3-methoxybenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[benzyl(cyclopropyl)amino]-1-m-anisoyl-pyrrolidine-2-carboxamide Formula: C29H38N4O3 MolecularWeight: 490.63702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)NC3CCC(CC3)N)N(CC4=CC=CC=C4)C5CC5

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)NC3CCC(CC3)N)N(CC4=CC=CC=C4)C5CC5

InChI

InChI=1S/C29H38N4O3/c1-36-26-9-5-8-21(16-26)29(35)33-19-25(32(24-14-15-24)18-20-6-3-2-4-7-20)17-27(33)28(34)31-23-12-10-22(30)11-13-23/h2-9,16,22-25,27H,10-15,17-19,30H2,1H3,(H,31,34)