N-[(E)-1-(4-methylphenyl)ethylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[(E)-1-(4-methylphenyl)ethylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[(E)-1-(p-tolyl)ethylideneamino]phthalazine-1-carboxamide CAS Name: N-[(E)-1-(4-methylphenyl)ethylideneamino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(E)-1-(4-methylphenyl)ethylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[(E)-1-(p-tolyl)ethylideneamino]phthalazine-1-carboxamide Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)/C(=N/NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)/C

InChI

InChI=1S/C25H22N4O2/c1-17-12-14-20(15-13-17)18(2)26-27-24(30)23-21-10-6-7-11-22(21)25(31)29(28-23)16-19-8-4-3-5-9-19/h3-15H,16H2,1-2H3,(H,27,30)/b26-18+