N-(4-azanylcyclohexyl)-1-(4-methylphenyl)carbonyl-4-[2-methylpropyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(4-methylphenyl)carbonyl-4-[2-methylpropyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[benzyl(isobutyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(4-methylphenyl)-oxomethyl]-4-[2-methylpropyl-(phenylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[benzyl(2-methylpropyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[benzyl(isobutyl)amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C30H42N4O2 MolecularWeight: 490.68008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NC3CCC(CC3)N)N(CC4=CC=CC=C4)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NC3CCC(CC3)N)N(CC4=CC=CC=C4)CC(C)C

InChI

InChI=1S/C30H42N4O2/c1-21(2)18-33(19-23-7-5-4-6-8-23)27-17-28(29(35)32-26-15-13-25(31)14-16-26)34(20-27)30(36)24-11-9-22(3)10-12-24/h4-12,21,25-28H,13-20,31H2,1-3H3,(H,32,35)