N-(3-chloranyl-2-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[1-(4-fluorophenyl)-5-methyl-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[1-(4-fluorophenyl)-5-methylpyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]cinchoninamide Formula: C27H20ClFN4O MolecularWeight: 470.925303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C5=CC=C(C=C5)F)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C5=CC=C(C=C5)F)C

InChI

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