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

Systemtic Name: 5-(2-fluoranylethylamino)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]pentanamide hydrochloride Openeye Name: 5-(2-fluoroethylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide hydrochloride CAS Name: 5-(2-fluoroethylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide hydrochloride IUPAC Name: 5-(2-fluoroethylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide hydrochloride Traditional Name: 5-(2-fluoroethylamino)-N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]valeramide hydrochloride Formula: C21H24ClFN4O2 MolecularWeight: 418.892263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23FN4O2.ClH/c22-11-13-23-12-4-3-10-19(27)24-16-7-5-6-15(14-16)20-17-8-1-2-9-18(17)21(28)26-25-20;/h1-2,5-9,14,23H,3-4,10-13H2,(H,24,27)(H,26,28);1H