3-[[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]methyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]methyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[[ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]amino]methyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]methyl]-N-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]methyl]-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-[[ethyl-(3-fluoro-4-methoxy-benzyl)amino]methyl]-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C21H23FN4O3 MolecularWeight: 398.430723

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC

InChI

InChI=1S/C21H23FN4O3/c1-4-25(12-14-9-10-18(29-3)17(22)11-14)13-26-21(28)16-8-6-5-7-15(16)19(24-26)20(27)23-2/h5-11H,4,12-13H2,1-3H3,(H,23,27)