N-[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[4-[(3-cyano-2-pyridinyl)oxy]-2-methylphenyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methylphenyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C28H19N5O3 MolecularWeight: 473.48216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C=CC=N2)C#N)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=CC=N2)C#N)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H19N5O3/c1-18-16-21(36-27-19(17-29)8-7-15-30-27)13-14-24(18)31-26(34)25-22-11-5-6-12-23(22)28(35)33(32-25)20-9-3-2-4-10-20/h2-16H,1H3,(H,31,34)