6-bromanyl-2-(2,5-dimethylphenyl)-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(2,5-dimethylphenyl)-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]quinoline-4-carboxamide Openeye Name: 6-bromo-2-(2,5-dimethylphenyl)-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(2,5-dimethylphenyl)-N-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(2,5-dimethylphenyl)-N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]quinoline-4-carboxamide Traditional Name: 6-bromo-2-(2,5-dimethylphenyl)-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]cinchoninamide Formula: C25H25BrN4O MolecularWeight: 477.3962

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CCN1C=C(C(=N1)C)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C25H25BrN4O/c1-5-30-14-18(17(4)29-30)13-27-25(31)22-12-24(20-10-15(2)6-7-16(20)3)28-23-9-8-19(26)11-21(22)23/h6-12,14H,5,13H2,1-4H3,(H,27,31)