N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C3=CC(=CC=C3)F)N(C)C

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C3=CC(=CC=C3)F)N(C)C

InChI

InChI=1S/C22H25FN4O2/c1-14(2)27-22(29)18-11-6-5-10-17(18)20(25-27)21(28)24-13-19(26(3)4)15-8-7-9-16(23)12-15/h5-12,14,19H,13H2,1-4H3,(H,24,28)