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

Systemtic Name: 4-oxidanylidene-3-phenyl-N-[4-(pyridin-3-ylcarbamoyl)phenyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-phenyl-N-[4-(3-pyridylcarbamoyl)phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-N-[4-[oxo-(3-pyridinylamino)methyl]phenyl]-3-phenyl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-phenyl-N-[4-(pyridin-3-ylcarbamoyl)phenyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-phenyl-N-[4-(3-pyridylcarbamoyl)phenyl]phthalazine-1-carboxamide Formula: C27H19N5O3 MolecularWeight: 461.47146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CN=CC=C5

InChI

InChI=1S/C27H19N5O3/c33-25(30-20-7-6-16-28-17-20)18-12-14-19(15-13-18)29-26(34)24-22-10-4-5-11-23(22)27(35)32(31-24)21-8-2-1-3-9-21/h1-17H,(H,29,34)(H,30,33)