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

Systemtic Name: 6-bromanyl-2-(4-ethoxyphenyl)-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-ethoxyphenyl)-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-ethoxyphenyl)-N-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-ethoxyphenyl)-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]quinoline-4-carboxamide Traditional Name: 6-bromo-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-2-p-phenetyl-cinchoninamide Formula: C25H25BrN4O2 MolecularWeight: 493.3956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25BrN4O2/c1-4-30-16(3)18(15-28-30)14-27-25(31)22-13-24(17-6-9-20(10-7-17)32-5-2)29-23-11-8-19(26)12-21(22)23/h6-13,15H,4-5,14H2,1-3H3,(H,27,31)