N-[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(3,5-dimethoxyphenyl)-(1-methyl-2-imidazolyl)methyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC(=CC(=C2)OC)OC)NC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CN1C=CN=C1C(C2=CC(=CC(=C2)OC)OC)NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C22H21N5O4/c1-27-9-8-23-20(27)18(13-10-14(30-2)12-15(11-13)31-3)24-22(29)19-16-6-4-5-7-17(16)21(28)26-25-19/h4-12,18H,1-3H3,(H,24,29)(H,26,28)