N-[(Z)-1-(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)ethylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)ethylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(3-fluoro-4-pyrrolidin-1-yl-phenyl)ethylideneamino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-[3-fluoro-4-(1-pyrrolidinyl)phenyl]ethylideneamino]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(3-fluoro-4-pyrrolidin-1-ylphenyl)ethylideneamino]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-1-(3-fluoro-4-pyrrolidino-phenyl)ethylideneamino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H22FN5O2 MolecularWeight: 407.440783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)C3=CC(=C(C=C3)N4CCCC4)F

Isomeric SMILES

C/C(=N/NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)/C3=CC(=C(C=C3)N4CCCC4)F

InChI

InChI=1S/C22H22FN5O2/c1-14(15-9-10-19(18(23)13-15)28-11-5-6-12-28)24-25-21(29)20-16-7-3-4-8-17(16)22(30)27(2)26-20/h3-4,7-10,13H,5-6,11-12H2,1-2H3,(H,25,29)/b24-14-