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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC(C)C)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NCCN

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC(C)C)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NCCN

InChI

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