N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[isobutyl(p-tolylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[cyclopropyl(oxo)methyl]-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[isobutyl-(4-methylbenzyl)amino]pyrrolidine-2-carboxamide Formula: C27H42N4O2 MolecularWeight: 454.64798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC(C)C)C2CC(N(C2)C(=O)C3CC3)C(=O)NC4CCC(CC4)N

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC(C)C)C2CC(N(C2)C(=O)C3CC3)C(=O)NC4CCC(CC4)N

InChI

InChI=1S/C27H42N4O2/c1-18(2)15-30(16-20-6-4-19(3)5-7-20)24-14-25(31(17-24)27(33)21-8-9-21)26(32)29-23-12-10-22(28)11-13-23/h4-7,18,21-25H,8-17,28H2,1-3H3,(H,29,32)