N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]adamantane-1-carboxamide Openeye Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]adamantane-1-carboxamide CAS Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]adamantane-1-carboxamide Traditional Name: N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]adamantane-1-carboxamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCNC4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCNC4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C22H28N4O2/c27-20-18-5-2-1-4-17(18)19(25-26-20)23-6-3-7-24-21(28)22-11-14-8-15(12-22)10-16(9-14)13-22/h1-2,4-5,14-16H,3,6-13H2,(H,23,25)(H,24,28)(H,26,27)