4-oxidanylidene-N-[4-(oxolan-2-ylmethylcarbamoylamino)phenyl]-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[4-(oxolan-2-ylmethylcarbamoylamino)phenyl]-3-phenyl-phthalazine-1-carboxamide Openeye Name: 4-oxo-3-phenyl-N-[4-(tetrahydrofuran-2-ylmethylcarbamoylamino)phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-N-[4-[[oxo-(2-oxolanylmethylamino)methyl]amino]phenyl]-3-phenyl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-N-[4-(oxolan-2-ylmethylcarbamoylamino)phenyl]-3-phenylphthalazine-1-carboxamide Traditional Name: 4-keto-3-phenyl-N-[4-(tetrahydrofurfurylcarbamoylamino)phenyl]phthalazine-1-carboxamide Formula: C27H25N5O4 MolecularWeight: 483.5185

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)NC2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CNC(=O)NC2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H25N5O4/c33-25(29-18-12-14-19(15-13-18)30-27(35)28-17-21-9-6-16-36-21)24-22-10-4-5-11-23(22)26(34)32(31-24)20-7-2-1-3-8-20/h1-5,7-8,10-15,21H,6,9,16-17H2,(H,29,33)(H2,28,30,35)