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

Systemtic Name: N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-4-[(2-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[2-morpholinoethyl(o-tolylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[cyclopropyl(oxo)methyl]-4-[(2-methylphenyl)methyl-[2-(4-morpholinyl)ethyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[(2-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[(2-methylbenzyl)-(2-morpholinoethyl)amino]pyrrolidine-2-carboxamide Formula: C29H45N5O3 MolecularWeight: 511.6993

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CCN2CCOCC2)C3CC(N(C3)C(=O)C4CC4)C(=O)NC5CCC(CC5)N

Isomeric SMILES

CC1=CC=CC=C1CN(CCN2CCOCC2)C3CC(N(C3)C(=O)C4CC4)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C29H45N5O3/c1-21-4-2-3-5-23(21)19-33(13-12-32-14-16-37-17-15-32)26-18-27(34(20-26)29(36)22-6-7-22)28(35)31-25-10-8-24(30)9-11-25/h2-5,22,24-27H,6-20,30H2,1H3,(H,31,35)