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

Systemtic Name: 2-cyclopropyl-N-[4-(3-methylbutanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-[4-(3-methylbutanoylamino)phenyl]quinoline-4-carboxamide CAS Name: 2-cyclopropyl-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-4-quinolinecarboxamide IUPAC Name: 2-cyclopropyl-N-[4-(3-methylbutanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-[4-(isovalerylamino)phenyl]cinchoninamide Formula: C24H25N3O2 MolecularWeight: 387.4742

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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)C4CC4

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4CC4

InChI

InChI=1S/C24H25N3O2/c1-15(2)13-23(28)25-17-9-11-18(12-10-17)26-24(29)20-14-22(16-7-8-16)27-21-6-4-3-5-19(20)21/h3-6,9-12,14-16H,7-8,13H2,1-2H3,(H,25,28)(H,26,29)