N-(2-azanylethyl)-4-[(2-methylphenyl)methyl-(oxolan-2-ylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[(2-methylphenyl)methyl-(oxolan-2-ylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[o-tolylmethyl(tetrahydrofuran-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[(2-methylphenyl)methyl-(2-oxolanylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[(2-methylphenyl)methyl-(oxolan-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[(2-methylbenzyl)-(tetrahydrofurfuryl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C26H35N5O3 MolecularWeight: 465.5878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC2CCCO2)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)NCCN

Isomeric SMILES

CC1=CC=CC=C1CN(CC2CCCO2)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)NCCN

InChI

InChI=1S/C26H35N5O3/c1-19-6-2-3-7-21(19)16-30(18-23-9-5-13-34-23)22-14-24(25(32)29-12-10-27)31(17-22)26(33)20-8-4-11-28-15-20/h2-4,6-8,11,15,22-24H,5,9-10,12-14,16-18,27H2,1H3,(H,29,32)