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

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-(4-chloro-2-methylphenyl)-2-[1-(4-ethylphenyl)-5-methyl-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(4-chloro-2-methylphenyl)-2-[1-(4-ethylphenyl)-5-methylpyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]cinchoninamide Formula: C29H25ClN4O MolecularWeight: 480.988

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=C(C=C(C=C5)Cl)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=C(C=C(C=C5)Cl)C)C

InChI

InChI=1S/C29H25ClN4O/c1-4-20-9-12-22(13-10-20)34-19(3)25(17-31-34)28-16-24(23-7-5-6-8-27(23)32-28)29(35)33-26-14-11-21(30)15-18(26)2/h5-17H,4H2,1-3H3,(H,33,35)