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

Systemtic Name: 1-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-(4-phenylmethoxyphenyl)urea Openeye Name: 1-(4-benzyloxyphenyl)-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea CAS Name: 1-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(4-phenylmethoxyphenyl)urea IUPAC Name: 1-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(4-phenylmethoxyphenyl)urea Traditional Name: 1-(4-benzoxyphenyl)-3-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]urea Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)NCCCNC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)NCCCNC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C25H25N5O3/c31-24-22-10-5-4-9-21(22)23(29-30-24)26-15-6-16-27-25(32)28-19-11-13-20(14-12-19)33-17-18-7-2-1-3-8-18/h1-5,7-14H,6,15-17H2,(H,26,29)(H,30,31)(H2,27,28,32)