2-[2,4-bis(fluoranyl)phenyl]-1-oxidanylidene-N-pyridin-2-yl-isoquinoline-4-carboxamide

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-1-oxidanylidene-N-pyridin-2-yl-isoquinoline-4-carboxamide Openeye Name: 2-(2,4-difluorophenyl)-1-oxo-N-(2-pyridyl)isoquinoline-4-carboxamide CAS Name: 2-(2,4-difluorophenyl)-1-oxo-N-(2-pyridinyl)-4-isoquinolinecarboxamide IUPAC Name: 2-(2,4-difluorophenyl)-1-oxo-N-pyridin-2-ylisoquinoline-4-carboxamide Traditional Name: 2-(2,4-difluorophenyl)-1-keto-N-(2-pyridyl)isoquinoline-4-carboxamide Formula: C21H13F2N3O2 MolecularWeight: 377.343626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN(C2=O)C3=C(C=C(C=C3)F)F)C(=O)NC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN(C2=O)C3=C(C=C(C=C3)F)F)C(=O)NC4=CC=CC=N4

InChI

InChI=1S/C21H13F2N3O2/c22-13-8-9-18(17(23)11-13)26-12-16(14-5-1-2-6-15(14)21(26)28)20(27)25-19-7-3-4-10-24-19/h1-12H,(H,24,25,27)