3-[4-(1-adamantylcarbonyl)piperazin-1-yl]carbonyl-1H-pyridazin-6-one

Systemtic Name: 3-[4-(1-adamantylcarbonyl)piperazin-1-yl]carbonyl-1H-pyridazin-6-one Openeye Name: 3-[4-(adamantane-1-carbonyl)piperazine-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[[4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(adamantane-1-carbonyl)piperazine-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(adamantane-1-carbonyl)piperazine-1-carbonyl]-1H-pyridazin-6-one Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NNC(=O)C=C2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=NNC(=O)C=C2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H26N4O3/c25-17-2-1-16(21-22-17)18(26)23-3-5-24(6-4-23)19(27)20-10-13-7-14(11-20)9-15(8-13)12-20/h1-2,13-15H,3-12H2,(H,22,25)