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

Systemtic Name: 1-diethoxyphosphoryl-3-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]urea Openeye Name: 1-diethoxyphosphoryl-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea CAS Name: 1-diethoxyphosphoryl-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea IUPAC Name: 1-diethoxyphosphoryl-3-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]urea Traditional Name: 1-diethoxyphosphoryl-3-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]urea Formula: C16H24N5O5P MolecularWeight: 397.366021

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(NC(=O)NCCCNC1=NNC(=O)C2=CC=CC=C21)OCC

Isomeric SMILES

CCOP(=O)(NC(=O)NCCCNC1=NNC(=O)C2=CC=CC=C21)OCC

InChI

InChI=1S/C16H24N5O5P/c1-3-25-27(24,26-4-2)21-16(23)18-11-7-10-17-14-12-8-5-6-9-13(12)15(22)20-19-14/h5-6,8-9H,3-4,7,10-11H2,1-2H3,(H,17,19)(H,20,22)(H2,18,21,23,24)