N-(5-chloranyl-2-fluoranyl-phenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-fluoranyl-phenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(5-chloro-2-fluoro-phenyl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(5-chloro-2-fluorophenyl)-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(5-chloro-2-fluorophenyl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(5-chloro-2-fluoro-phenyl)-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C19H17ClFN3O2 MolecularWeight: 373.808583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)Cl)F

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C19H17ClFN3O2/c1-11(2)10-24-19(26)14-6-4-3-5-13(14)17(23-24)18(25)22-16-9-12(20)7-8-15(16)21/h3-9,11H,10H2,1-2H3,(H,22,25)