3-butyl-N-(5-fluoranyl-2-methyl-phenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-(5-fluoranyl-2-methyl-phenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-(5-fluoro-2-methyl-phenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-(5-fluoro-2-methylphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-(5-fluoro-2-methylphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-(5-fluoro-2-methyl-phenyl)-4-keto-phthalazine-1-carboxamide Formula: C20H20FN3O2 MolecularWeight: 353.390103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)F)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)F)C

InChI

InChI=1S/C20H20FN3O2/c1-3-4-11-24-20(26)16-8-6-5-7-15(16)18(23-24)19(25)22-17-12-14(21)10-9-13(17)2/h5-10,12H,3-4,11H2,1-2H3,(H,22,25)