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

Systemtic Name: 2-(1-adamantyl)-4-chloranyl-5-[4-(3-chlorophenyl)piperazin-1-yl]pyridazin-3-one Openeye Name: 2-(1-adamantyl)-4-chloro-5-[4-(3-chlorophenyl)piperazin-1-yl]pyridazin-3-one CAS Name: 2-(1-adamantyl)-4-chloro-5-[4-(3-chlorophenyl)-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-(1-adamantyl)-4-chloro-5-[4-(3-chlorophenyl)piperazin-1-yl]pyridazin-3-one Traditional Name: 2-(1-adamantyl)-4-chloro-5-[4-(3-chlorophenyl)piperazino]pyridazin-3-one Formula: C24H28Cl2N4O MolecularWeight: 459.41132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28Cl2N4O/c25-19-2-1-3-20(11-19)28-4-6-29(7-5-28)21-15-27-30(23(31)22(21)26)24-12-16-8-17(13-24)10-18(9-16)14-24/h1-3,11,15-18H,4-10,12-14H2