N-[2-(2-methylpropanoylamino)ethyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(2-methylpropanoylamino)ethyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(2-methylpropanoylamino)ethyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-2-(4-pyridyl)cinchoninamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3

InChI

InChI=1S/C21H22N4O2/c1-14(2)20(26)23-11-12-24-21(27)17-13-19(15-7-9-22-10-8-15)25-18-6-4-3-5-16(17)18/h3-10,13-14H,11-12H2,1-2H3,(H,23,26)(H,24,27)