1-[2-oxidanyl-3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-(2-phenylcyclopropyl)urea

Systemtic Name: 1-[2-oxidanyl-3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-(2-phenylcyclopropyl)urea Openeye Name: 1-[2-hydroxy-3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(2-phenylcyclopropyl)urea CAS Name: 1-[2-hydroxy-3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(2-phenylcyclopropyl)urea IUPAC Name: 1-[2-hydroxy-3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(2-phenylcyclopropyl)urea Traditional Name: 1-[2-hydroxy-3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-3-(2-phenylcyclopropyl)urea Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1NC(=O)NCC(CNC2=NNC(=O)C3=CC=CC=C32)O)C4=CC=CC=C4

Isomeric SMILES

C1C(C1NC(=O)NCC(CNC2=NNC(=O)C3=CC=CC=C32)O)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5O3/c27-14(11-22-19-15-8-4-5-9-16(15)20(28)26-25-19)12-23-21(29)24-18-10-17(18)13-6-2-1-3-7-13/h1-9,14,17-18,27H,10-12H2,(H,22,25)(H,26,28)(H2,23,24,29)