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

Systemtic Name: N-[(Z)-(3-fluoranyl-4-methoxy-phenyl)methylideneamino]-3-(3-methylbutyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(3-fluoro-4-methoxy-phenyl)methyleneamino]-3-isopentyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-(3-fluoro-4-methoxyphenyl)methylideneamino]-3-(3-methylbutyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-(3-fluoro-4-methoxyphenyl)methylideneamino]-3-(3-methylbutyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-(3-fluoro-4-methoxy-benzylidene)amino]-3-isoamyl-4-keto-phthalazine-1-carboxamide Formula: C22H23FN4O3 MolecularWeight: 410.441423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC(=C(C=C3)OC)F

Isomeric SMILES

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

InChI

InChI=1S/C22H23FN4O3/c1-14(2)10-11-27-22(29)17-7-5-4-6-16(17)20(26-27)21(28)25-24-13-15-8-9-19(30-3)18(23)12-15/h4-9,12-14H,10-11H2,1-3H3,(H,25,28)/b24-13-