1-(3-ethanoylphenyl)-3-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]urea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]urea Openeye Name: 1-(3-acetylphenyl)-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea CAS Name: 1-(3-acetylphenyl)-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea IUPAC Name: 1-(3-acetylphenyl)-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea Traditional Name: 1-(3-acetylphenyl)-3-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]urea Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H21N5O3/c1-13(26)14-6-4-7-15(12-14)23-20(28)22-11-5-10-21-18-16-8-2-3-9-17(16)19(27)25-24-18/h2-4,6-9,12H,5,10-11H2,1H3,(H,21,24)(H,25,27)(H2,22,23,28)