6-bromanyl-N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[2-[(1S)-1-methylpropyl]phenyl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[2-[(1S)-1-methylpropyl]phenyl]-2-(p-tolyl)cinchoninamide Formula: C27H25BrN2O MolecularWeight: 473.4042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)C

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H25BrN2O/c1-4-18(3)21-7-5-6-8-24(21)30-27(31)23-16-26(19-11-9-17(2)10-12-19)29-25-14-13-20(28)15-22(23)25/h5-16,18H,4H2,1-3H3,(H,30,31)/t18-/m0/s1