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

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[1-(4-ethylphenyl)-5-methyl-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-[1-(4-ethylphenyl)-5-methylpyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[1-(4-ethylphenyl)-5-methyl-pyrazol-4-yl]cinchoninamide Formula: C29H25ClN4O2 MolecularWeight: 496.9874

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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=CC(=C(C=C5)OC)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C29H25ClN4O2/c1-4-19-9-12-21(13-10-19)34-18(2)24(17-31-34)27-16-23(22-7-5-6-8-26(22)33-27)29(35)32-20-11-14-28(36-3)25(30)15-20/h5-17H,4H2,1-3H3,(H,32,35)