3-[2-[1-(1-adamantyl)ethylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[1-(1-adamantyl)ethylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[1-(1-adamantyl)ethylamino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[1-(1-adamantyl)ethylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[1-(1-adamantyl)ethylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[1-(1-adamantyl)ethylamino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN4C(=O)C5=CC=CC=C5C(=N4)C(=O)N

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN4C(=O)C5=CC=CC=C5C(=N4)C(=O)N

InChI

InChI=1S/C23H28N4O3/c1-13(23-9-14-6-15(10-23)8-16(7-14)11-23)25-19(28)12-27-22(30)18-5-3-2-4-17(18)20(26-27)21(24)29/h2-5,13-16H,6-12H2,1H3,(H2,24,29)(H,25,28)