N-[2-[bis(fluoranyl)methoxy]-4-methyl-phenyl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[2-[bis(fluoranyl)methoxy]-4-methyl-phenyl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[2-(difluoromethoxy)-4-methyl-phenyl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[2-(difluoromethoxy)-4-methylphenyl]-2-(1-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(difluoromethoxy)-4-methylphenyl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[2-(difluoromethoxy)-4-methyl-phenyl]-2-(1-methylpyrazol-4-yl)cinchoninamide Formula: C22H18F2N4O2 MolecularWeight: 408.400726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN(N=C4)C)OC(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN(N=C4)C)OC(F)F

InChI

InChI=1S/C22H18F2N4O2/c1-13-7-8-18(20(9-13)30-22(23)24)27-21(29)16-10-19(14-11-25-28(2)12-14)26-17-6-4-3-5-15(16)17/h3-12,22H,1-2H3,(H,27,29)