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

Systemtic Name: N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-ethyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-ethyl-N-(3-fluoro-4-methoxy-benzyl)-4-keto-phthalazine-1-carboxamide Formula: C26H24FN3O3 MolecularWeight: 445.485463

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C26H24FN3O3/c1-3-29(16-19-13-14-23(33-2)22(27)15-19)26(32)24-20-11-7-8-12-21(20)25(31)30(28-24)17-18-9-5-4-6-10-18/h4-15H,3,16-17H2,1-2H3