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

Systemtic Name: 6-bromanyl-2-(4-ethoxyphenyl)-N-[(1-methylpyrazol-4-yl)methyl]quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-ethoxyphenyl)-N-[(1-methylpyrazol-4-yl)methyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-ethoxyphenyl)-N-[(1-methyl-4-pyrazolyl)methyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-ethoxyphenyl)-N-[(1-methylpyrazol-4-yl)methyl]quinoline-4-carboxamide Traditional Name: 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]-2-p-phenetyl-cinchoninamide Formula: C23H21BrN4O2 MolecularWeight: 465.34244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC4=CN(N=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC4=CN(N=C4)C

InChI

InChI=1S/C23H21BrN4O2/c1-3-30-18-7-4-16(5-8-18)22-11-20(19-10-17(24)6-9-21(19)27-22)23(29)25-12-15-13-26-28(2)14-15/h4-11,13-14H,3,12H2,1-2H3,(H,25,29)