N-[[2-(diethylaminomethyl)phenyl]methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[2-(diethylaminomethyl)benzyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=CC=C1CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)CC1=CC=CC=C1CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4O2/c1-3-30(4-2)19-21-13-9-8-12-20(21)18-28-26(32)25-23-16-10-11-17-24(23)27(33)31(29-25)22-14-6-5-7-15-22/h5-17H,3-4,18-19H2,1-2H3,(H,28,32)