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

Systemtic Name: N-(2-azanylethyl)-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[isobutyl(o-tolylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[isobutyl-(2-methylbenzyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C25H35N5O2 MolecularWeight: 437.5777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC(C)C)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NCCN

Isomeric SMILES

CC1=CC=CC=C1CN(CC(C)C)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NCCN

InChI

InChI=1S/C25H35N5O2/c1-18(2)15-29(16-21-8-5-4-7-19(21)3)22-13-23(24(31)28-12-10-26)30(17-22)25(32)20-9-6-11-27-14-20/h4-9,11,14,18,22-23H,10,12-13,15-17,26H2,1-3H3,(H,28,31)