6-bromanyl-N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-2-phenyl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-2-phenyl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-2-phenyl-quinoline-4-carboxamide CAS Name: 6-bromo-N-[(1,3-dimethyl-4-pyrazolyl)methyl]-N-methyl-2-phenyl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-2-phenylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-2-phenyl-cinchoninamide Formula: C23H21BrN4O MolecularWeight: 449.34304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CN(C)C(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C=C1CN(C)C(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4)C

InChI

InChI=1S/C23H21BrN4O/c1-15-17(14-28(3)26-15)13-27(2)23(29)20-12-22(16-7-5-4-6-8-16)25-21-10-9-18(24)11-19(20)21/h4-12,14H,13H2,1-3H3