N-[(E)-(4-cyanophenyl)methylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[(E)-(4-cyanophenyl)methylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(E)-(4-cyanophenyl)methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-(4-cyanophenyl)methylideneamino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(E)-(4-cyanophenyl)methylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[(E)-(4-cyanobenzylidene)amino]-4-keto-phthalazine-1-carboxamide Formula: C24H17N5O2 MolecularWeight: 407.42408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NN=CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N/N=C/C4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H17N5O2/c25-14-17-10-12-18(13-11-17)15-26-27-23(30)22-20-8-4-5-9-21(20)24(31)29(28-22)16-19-6-2-1-3-7-19/h1-13,15H,16H2,(H,27,30)/b26-15+