6-bromanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-2-(4-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-p-phenetyl-cinchoninamide Formula: C26H27BrN4O2 MolecularWeight: 507.42218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCCN4C(=CC(=N4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCCN4C(=CC(=N4)C)C

InChI

InChI=1S/C26H27BrN4O2/c1-4-33-21-9-6-19(7-10-21)25-16-23(22-15-20(27)8-11-24(22)29-25)26(32)28-12-5-13-31-18(3)14-17(2)30-31/h6-11,14-16H,4-5,12-13H2,1-3H3,(H,28,32)