N-[2-(2-methylpropanoylamino)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(2-methylpropanoylamino)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(2-methylpropanoylamino)ethyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-2-(3-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=CN=CC=C3

Isomeric SMILES

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

InChI

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