N-(2-chloranyl-4-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-(2-chloro-4-methylphenyl)-2-[1-(4-fluorophenyl)-5-methyl-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(2-chloro-4-methylphenyl)-2-[1-(4-fluorophenyl)-5-methylpyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]cinchoninamide Formula: C27H20ClFN4O MolecularWeight: 470.925303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C5=CC=C(C=C5)F)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C5=CC=C(C=C5)F)C)Cl

InChI

InChI=1S/C27H20ClFN4O/c1-16-7-12-25(23(28)13-16)32-27(34)21-14-26(31-24-6-4-3-5-20(21)24)22-15-30-33(17(22)2)19-10-8-18(29)9-11-19/h3-15H,1-2H3,(H,32,34)