N-[2-[bis(2-methylpropyl)amino]ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-[bis(2-methylpropyl)amino]ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[2-(diisobutylamino)ethyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-[bis(2-methylpropyl)amino]ethyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[2-[bis(2-methylpropyl)amino]ethyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[2-(diisobutylamino)ethyl]-2-(3-pyridyl)cinchoninamide Formula: C25H32N4O MolecularWeight: 404.54778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3)CC(C)C

Isomeric SMILES

CC(C)CN(CCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3)CC(C)C

InChI

InChI=1S/C25H32N4O/c1-18(2)16-29(17-19(3)4)13-12-27-25(30)22-14-24(20-8-7-11-26-15-20)28-23-10-6-5-9-21(22)23/h5-11,14-15,18-19H,12-13,16-17H2,1-4H3,(H,27,30)