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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)NC5CCC(CC5)N

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)NC5CCC(CC5)N

InChI

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