(E)-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-4-phenyl-but-3-enamide

Systemtic Name: (E)-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-4-phenyl-but-3-enamide Openeye Name: (E)-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-4-phenyl-but-3-enamide CAS Name: (E)-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-4-phenyl-3-butenamide IUPAC Name: (E)-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-4-phenylbut-3-enamide Traditional Name: (E)-N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-4-phenyl-but-3-enamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCC(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CC(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H22N4O2/c26-19(13-6-10-16-8-2-1-3-9-16)22-14-7-15-23-20-17-11-4-5-12-18(17)21(27)25-24-20/h1-6,8-12H,7,13-15H2,(H,22,26)(H,23,24)(H,25,27)/b10-6+