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

Systemtic Name: N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(4-methoxyphenyl)-(1-methyl-2-imidazolyl)methyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-3H-phthalazine-1-carboxamide Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N5O3/c1-26-12-11-22-19(26)17(13-7-9-14(29-2)10-8-13)23-21(28)18-15-5-3-4-6-16(15)20(27)25-24-18/h3-12,17H,1-2H3,(H,23,28)(H,25,27)