2-(1-adamantyl)-4-chloranyl-5-[(5-chloranyl-2-oxidanyl-phenyl)amino]pyridazin-3-one

Systemtic Name: 2-(1-adamantyl)-4-chloranyl-5-[(5-chloranyl-2-oxidanyl-phenyl)amino]pyridazin-3-one Openeye Name: 2-(1-adamantyl)-4-chloro-5-(5-chloro-2-hydroxy-anilino)pyridazin-3-one CAS Name: 2-(1-adamantyl)-4-chloro-5-(5-chloro-2-hydroxyanilino)-3-pyridazinone IUPAC Name: 2-(1-adamantyl)-4-chloro-5-(5-chloro-2-hydroxyanilino)pyridazin-3-one Traditional Name: 2-(1-adamantyl)-4-chloro-5-(5-chloro-2-hydroxy-anilino)pyridazin-3-one Formula: C20H21Cl2N3O2 MolecularWeight: 406.30564

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C(=O)C(=C(C=N4)NC5=C(C=CC(=C5)Cl)O)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C(=O)C(=C(C=N4)NC5=C(C=CC(=C5)Cl)O)Cl

InChI

InChI=1S/C20H21Cl2N3O2/c21-14-1-2-17(26)15(6-14)24-16-10-23-25(19(27)18(16)22)20-7-11-3-12(8-20)5-13(4-11)9-20/h1-2,6,10-13,24,26H,3-5,7-9H2