N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)phenyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)phenyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O2/c1-2-30-16-18-31(19-17-30)21-14-12-20(13-15-21)28-26(33)25-23-10-6-7-11-24(23)27(34)32(29-25)22-8-4-3-5-9-22/h3-15H,2,16-19H2,1H3,(H,28,33)