2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-(2-phenylsulfanylphenyl)quinoline-4-carboxamide

Systemtic Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-(2-phenylsulfanylphenyl)quinoline-4-carboxamide Openeye Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-(2-phenylsulfanylphenyl)quinoline-4-carboxamide CAS Name: 2-(1-ethyl-5-methyl-4-pyrazolyl)-N-[2-(phenylthio)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(1-ethyl-5-methylpyrazol-4-yl)-N-(2-phenylsulfanylphenyl)quinoline-4-carboxamide Traditional Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-[2-(phenylthio)phenyl]cinchoninamide Formula: C28H24N4OS MolecularWeight: 464.58136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4SC5=CC=CC=C5)C

Isomeric SMILES

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4SC5=CC=CC=C5)C

InChI

InChI=1S/C28H24N4OS/c1-3-32-19(2)23(18-29-32)26-17-22(21-13-7-8-14-24(21)30-26)28(33)31-25-15-9-10-16-27(25)34-20-11-5-4-6-12-20/h4-18H,3H2,1-2H3,(H,31,33)