N-[4-[(2S)-butan-2-yl]phenyl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)-N-[4-[(1S)-1-methylpropyl]phenyl]quinoline-4-carboxamide CAS Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(2,5-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide Traditional Name: 2-(2,5-dimethylphenyl)-N-[4-[(1S)-1-methylpropyl]phenyl]cinchoninamide Formula: C28H28N2O MolecularWeight: 408.53472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C28H28N2O/c1-5-19(3)21-12-14-22(15-13-21)29-28(31)25-17-27(24-16-18(2)10-11-20(24)4)30-26-9-7-6-8-23(25)26/h6-17,19H,5H2,1-4H3,(H,29,31)/t19-/m0/s1