2-(1-adamantyl)-4-chloranyl-5-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-one

Systemtic Name: 2-(1-adamantyl)-4-chloranyl-5-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-one Openeye Name: 2-(1-adamantyl)-4-chloro-5-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-one CAS Name: 2-(1-adamantyl)-4-chloro-5-[4-(4-fluorophenyl)-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-(1-adamantyl)-4-chloro-5-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-one Traditional Name: 2-(1-adamantyl)-4-chloro-5-[4-(4-fluorophenyl)piperazino]pyridazin-3-one Formula: C24H28ClFN4O MolecularWeight: 442.956723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C(=O)N(N=C3)C45CC6CC(C4)CC(C6)C5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C(=O)N(N=C3)C45CC6CC(C4)CC(C6)C5)Cl

InChI

InChI=1S/C24H28ClFN4O/c25-22-21(29-7-5-28(6-8-29)20-3-1-19(26)2-4-20)15-27-30(23(22)31)24-12-16-9-17(13-24)11-18(10-16)14-24/h1-4,15-18H,5-14H2