6-bromanyl-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-phenyl-quinoline-4-carboxamide CAS Name: 6-bromo-N-methyl-N-[(1-methyl-4-pyrazolyl)methyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-phenylquinoline-4-carboxamide Traditional Name: 6-bromo-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-phenyl-cinchoninamide Formula: C22H19BrN4O MolecularWeight: 435.31646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(C)C(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)CN(C)C(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H19BrN4O/c1-26(13-15-12-24-27(2)14-15)22(28)19-11-21(16-6-4-3-5-7-16)25-20-9-8-17(23)10-18(19)20/h3-12,14H,13H2,1-2H3