N-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-4-oxidanylidene-3H-phthalazin-6-yl]-2-propyl-pentanamide

Systemtic Name: N-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-4-oxidanylidene-3H-phthalazin-6-yl]-2-propyl-pentanamide Openeye Name: N-[1-[(4-chloro-3-fluoro-phenyl)methyl]-4-oxo-3H-phthalazin-6-yl]-2-propyl-pentanamide CAS Name: N-[1-[(4-chloro-3-fluorophenyl)methyl]-4-oxo-3H-phthalazin-6-yl]-2-propylpentanamide IUPAC Name: N-[1-[(4-chloro-3-fluorophenyl)methyl]-4-oxo-3H-phthalazin-6-yl]-2-propylpentanamide Traditional Name: N-[1-(4-chloro-3-fluoro-benzyl)-4-keto-3H-phthalazin-6-yl]-2-propyl-valeramide Formula: C23H25ClFN3O2 MolecularWeight: 429.914903

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=CC2=C(C=C1)C(=NNC2=O)CC3=CC(=C(C=C3)Cl)F

Isomeric SMILES

CCCC(CCC)C(=O)NC1=CC2=C(C=C1)C(=NNC2=O)CC3=CC(=C(C=C3)Cl)F

InChI

InChI=1S/C23H25ClFN3O2/c1-3-5-15(6-4-2)22(29)26-16-8-9-17-18(13-16)23(30)28-27-21(17)12-14-7-10-19(24)20(25)11-14/h7-11,13,15H,3-6,12H2,1-2H3,(H,26,29)(H,28,30)