N-(4-azanylcyclohexyl)-1-(3-methoxyphenyl)carbonyl-4-[(2-methylphenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(3-methoxyphenyl)carbonyl-4-[(2-methylphenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(3-methoxybenzoyl)-4-[o-tolylmethyl(phenethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(3-methoxyphenyl)-oxomethyl]-4-[(2-methylphenyl)methyl-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(3-methoxybenzoyl)-4-[(2-methylphenyl)methyl-phenethylamino]pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-m-anisoyl-4-[(2-methylbenzyl)-phenethyl-amino]pyrrolidine-2-carboxamide Formula: C35H44N4O3 MolecularWeight: 568.74886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)NC5CCC(CC5)N

Isomeric SMILES

CC1=CC=CC=C1CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C35H44N4O3/c1-25-9-6-7-12-28(25)23-38(20-19-26-10-4-3-5-11-26)31-22-33(34(40)37-30-17-15-29(36)16-18-30)39(24-31)35(41)27-13-8-14-32(21-27)42-2/h3-14,21,29-31,33H,15-20,22-24,36H2,1-2H3,(H,37,40)