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

Systemtic Name: N-(2-azanylethyl)-1-cyclopropylcarbonyl-4-[(4-methylphenyl)methyl-phenethyl-amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(cyclopropanecarbonyl)-4-[phenethyl(p-tolylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[cyclopropyl(oxo)methyl]-4-[(4-methylphenyl)methyl-phenethylamino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(cyclopropanecarbonyl)-4-[(4-methylphenyl)methyl-phenethylamino]pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(cyclopropanecarbonyl)-4-[(4-methylbenzyl)-phenethyl-amino]pyrrolidine-2-carboxamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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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)C4CC4)C(=O)NCCN

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4CC4)C(=O)NCCN

InChI

InChI=1S/C27H36N4O2/c1-20-7-9-22(10-8-20)18-30(16-13-21-5-3-2-4-6-21)24-17-25(26(32)29-15-14-28)31(19-24)27(33)23-11-12-23/h2-10,23-25H,11-19,28H2,1H3,(H,29,32)