N-[4-(3-methylbutanoylamino)phenyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[4-(3-methylbutanoylamino)phenyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[4-(3-methylbutanoylamino)phenyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[4-(3-methylbutanoylamino)phenyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[4-(isovalerylamino)phenyl]-2-(4-pyridyl)cinchoninamide Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C26H24N4O2/c1-17(2)15-25(31)28-19-7-9-20(10-8-19)29-26(32)22-16-24(18-11-13-27-14-12-18)30-23-6-4-3-5-21(22)23/h3-14,16-17H,15H2,1-2H3,(H,28,31)(H,29,32)