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

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]urea Openeye Name: 1-(3,4-dimethoxyphenyl)-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea CAS Name: 1-(3,4-dimethoxyphenyl)-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea Traditional Name: 1-(3,4-dimethoxyphenyl)-3-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]urea Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32)OC

InChI

InChI=1S/C20H23N5O4/c1-28-16-9-8-13(12-17(16)29-2)23-20(27)22-11-5-10-21-18-14-6-3-4-7-15(14)19(26)25-24-18/h3-4,6-9,12H,5,10-11H2,1-2H3,(H,21,24)(H,25,26)(H2,22,23,27)