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

Systemtic Name: N-[(E)-1-(3-acetamidophenyl)ethylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: N-[(E)-1-(3-acetamidophenyl)ethylideneamino]-3-benzyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-1-(3-acetamidophenyl)ethylideneamino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: N-[(E)-1-(3-acetamidophenyl)ethylideneamino]-3-benzyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(E)-1-(3-acetamidophenyl)ethylideneamino]-3-benzyl-4-keto-phthalazine-1-carboxamide Formula: C26H23N5O3 MolecularWeight: 453.49252

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)C4=CC(=CC=C4)NC(=O)C

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)/C4=CC(=CC=C4)NC(=O)C

InChI

InChI=1S/C26H23N5O3/c1-17(20-11-8-12-21(15-20)27-18(2)32)28-29-25(33)24-22-13-6-7-14-23(22)26(34)31(30-24)16-19-9-4-3-5-10-19/h3-15H,16H2,1-2H3,(H,27,32)(H,29,33)/b28-17+