N-[(Z)-1-(3-fluoranyl-4-methoxy-phenyl)ethylideneamino]-3-(3-methylbutyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(3-fluoranyl-4-methoxy-phenyl)ethylideneamino]-3-(3-methylbutyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(3-fluoro-4-methoxy-phenyl)ethylideneamino]-3-isopentyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(3-fluoro-4-methoxyphenyl)ethylideneamino]-3-(3-methylbutyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(3-fluoro-4-methoxyphenyl)ethylideneamino]-3-(3-methylbutyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-1-(3-fluoro-4-methoxy-phenyl)ethylideneamino]-3-isoamyl-4-keto-phthalazine-1-carboxamide Formula: C23H25FN4O3 MolecularWeight: 424.468003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(/C)\C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C23H25FN4O3/c1-14(2)11-12-28-23(30)18-8-6-5-7-17(18)21(27-28)22(29)26-25-15(3)16-9-10-20(31-4)19(24)13-16/h5-10,13-14H,11-12H2,1-4H3,(H,26,29)/b25-15-