4-oxidanylidene-3-(phenylmethyl)-N-[(E)-1-pyridin-3-ylethylideneamino]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-[(E)-1-pyridin-3-ylethylideneamino]phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[(E)-1-(3-pyridyl)ethylideneamino]phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-[(E)-1-(3-pyridinyl)ethylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[(E)-1-pyridin-3-ylethylideneamino]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[(E)-1-(3-pyridyl)ethylideneamino]phthalazine-1-carboxamide Formula: C23H19N5O2 MolecularWeight: 397.42926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N5O2/c1-16(18-10-7-13-24-14-18)25-26-22(29)21-19-11-5-6-12-20(19)23(30)28(27-21)15-17-8-3-2-4-9-17/h2-14H,15H2,1H3,(H,26,29)/b25-16+