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

Systemtic Name: N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]-4-keto-phthalazine-1-carboxamide Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24N4O2/c1-17-13-14-21(15-18(17)2)19(3)27-28-25(31)24-22-11-7-8-12-23(22)26(32)30(29-24)16-20-9-5-4-6-10-20/h4-15H,16H2,1-3H3,(H,28,31)/b27-19+