N-[2-chloranyl-5-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-5-(2-fluoranylethylamino)pentanamide

Systemtic Name: N-[2-chloranyl-5-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-5-(2-fluoranylethylamino)pentanamide Openeye Name: N-[2-chloro-5-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(2-fluoroethylamino)pentanamide CAS Name: N-[2-chloro-5-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(2-fluoroethylamino)pentanamide IUPAC Name: N-[2-chloro-5-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-(2-fluoroethylamino)pentanamide Traditional Name: N-[2-chloro-5-(4-keto-3H-phthalazin-1-yl)phenyl]-5-(2-fluoroethylamino)valeramide Formula: C21H22ClFN4O2 MolecularWeight: 416.876383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=C(C=C3)Cl)NC(=O)CCCCNCCF

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=C(C=C3)Cl)NC(=O)CCCCNCCF

InChI

InChI=1S/C21H22ClFN4O2/c22-17-9-8-14(20-15-5-1-2-6-16(15)21(29)27-26-20)13-18(17)25-19(28)7-3-4-11-24-12-10-23/h1-2,5-6,8-9,13,24H,3-4,7,10-12H2,(H,25,28)(H,27,29)