6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide

Systemtic Name: 6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide Openeye Name: 6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide CAS Name: 6-methyl-2-[5-methyl-1-(4-methylphenyl)-4-pyrazolyl]-N-[3-(methylthio)phenyl]-4-quinolinecarboxamide IUPAC Name: 6-methyl-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide Traditional Name: 6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]-N-[3-(methylthio)phenyl]cinchoninamide Formula: C29H26N4OS MolecularWeight: 478.60794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)NC5=CC(=CC=C5)SC)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)NC5=CC(=CC=C5)SC)C

InChI

InChI=1S/C29H26N4OS/c1-18-8-11-22(12-9-18)33-20(3)26(17-30-33)28-16-25(24-14-19(2)10-13-27(24)32-28)29(34)31-21-6-5-7-23(15-21)35-4/h5-17H,1-4H3,(H,31,34)