4-oxidanylidene-3-(phenylmethyl)-N-[3-(pyridin-3-ylcarbonylamino)phenyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-[3-(pyridin-3-ylcarbonylamino)phenyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[3-(pyridine-3-carbonylamino)phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-N-[3-[[oxo(3-pyridinyl)methyl]amino]phenyl]-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[3-(pyridine-3-carbonylamino)phenyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-(3-nicotinamidophenyl)phthalazine-1-carboxamide Formula: C28H21N5O3 MolecularWeight: 475.49804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=CC(=C4)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=CC(=C4)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C28H21N5O3/c34-26(20-10-7-15-29-17-20)30-21-11-6-12-22(16-21)31-27(35)25-23-13-4-5-14-24(23)28(36)33(32-25)18-19-8-2-1-3-9-19/h1-17H,18H2,(H,30,34)(H,31,35)