8-fluoranyl-4-[[pyrazin-2-yl-[3-(trifluoromethyl)phenyl]amino]methyl]-1H-quinolin-2-one

Systemtic Name: 8-fluoranyl-4-[[pyrazin-2-yl-[3-(trifluoromethyl)phenyl]amino]methyl]-1H-quinolin-2-one Openeye Name: 8-fluoro-4-[[N-pyrazin-2-yl-3-(trifluoromethyl)anilino]methyl]-1H-quinolin-2-one CAS Name: 8-fluoro-4-[[N-(2-pyrazinyl)-3-(trifluoromethyl)anilino]methyl]-1H-quinolin-2-one IUPAC Name: 8-fluoro-4-[[N-pyrazin-2-yl-3-(trifluoromethyl)anilino]methyl]-1H-quinolin-2-one Traditional Name: 8-fluoro-4-[[N-pyrazin-2-yl-3-(trifluoromethyl)anilino]methyl]carbostyril Formula: C21H14F4N4O MolecularWeight: 414.355673

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N(CC2=CC(=O)NC3=C2C=CC=C3F)C4=NC=CN=C4)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N(CC2=CC(=O)NC3=C2C=CC=C3F)C4=NC=CN=C4)C(F)(F)F

InChI

InChI=1S/C21H14F4N4O/c22-17-6-2-5-16-13(9-19(30)28-20(16)17)12-29(18-11-26-7-8-27-18)15-4-1-3-14(10-15)21(23,24)25/h1-11H,12H2,(H,28,30)