N-(2-azanylethyl)-1-ethanoyl-4-[(4-methylphenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-ethanoyl-4-[(4-methylphenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(2-aminoethyl)-4-[phenethyl(p-tolylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(2-aminoethyl)-4-[(4-methylphenyl)methyl-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(2-aminoethyl)-4-[(4-methylphenyl)methyl-phenethylamino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(2-aminoethyl)-4-[(4-methylbenzyl)-phenethyl-amino]pyrrolidine-2-carboxamide Formula: C25H34N4O2 MolecularWeight: 422.56306

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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)C)C(=O)NCCN

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C)C(=O)NCCN

InChI

InChI=1S/C25H34N4O2/c1-19-8-10-22(11-9-19)17-28(15-12-21-6-4-3-5-7-21)23-16-24(25(31)27-14-13-26)29(18-23)20(2)30/h3-11,23-24H,12-18,26H2,1-2H3,(H,27,31)