2-(1-adamantyl)-4-chloranyl-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]pyridazin-3-one

Systemtic Name: 2-(1-adamantyl)-4-chloranyl-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]pyridazin-3-one Openeye Name: 2-(1-adamantyl)-4-chloro-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]pyridazin-3-one CAS Name: 2-(1-adamantyl)-4-chloro-5-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-(1-adamantyl)-4-chloro-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]pyridazin-3-one Traditional Name: 2-(1-adamantyl)-4-chloro-5-[4-(3,4-dichlorophenyl)sulfonylpiperazino]pyridazin-3-one Formula: C24H27Cl3N4O3S MolecularWeight: 557.92018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)C34CC5CC(C3)CC(C5)C4)Cl)S(=O)(=O)C6=CC(=C(C=C6)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C34CC5CC(C3)CC(C5)C4)Cl)S(=O)(=O)C6=CC(=C(C=C6)Cl)Cl

InChI

InChI=1S/C24H27Cl3N4O3S/c25-19-2-1-18(10-20(19)26)35(33,34)30-5-3-29(4-6-30)21-14-28-31(23(32)22(21)27)24-11-15-7-16(12-24)9-17(8-15)13-24/h1-2,10,14-17H,3-9,11-13H2