2-(1-adamantyl)-4-chloranyl-5-[(2-methoxyphenyl)methylamino]pyridazin-3-one

Systemtic Name: 2-(1-adamantyl)-4-chloranyl-5-[(2-methoxyphenyl)methylamino]pyridazin-3-one Openeye Name: 2-(1-adamantyl)-4-chloro-5-[(2-methoxyphenyl)methylamino]pyridazin-3-one CAS Name: 2-(1-adamantyl)-4-chloro-5-[(2-methoxyphenyl)methylamino]-3-pyridazinone IUPAC Name: 2-(1-adamantyl)-4-chloro-5-[(2-methoxyphenyl)methylamino]pyridazin-3-one Traditional Name: 2-(1-adamantyl)-4-chloro-5-(o-anisylamino)pyridazin-3-one Formula: C22H26ClN3O2 MolecularWeight: 399.91374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC2=C(C(=O)N(N=C2)C34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

COC1=CC=CC=C1CNC2=C(C(=O)N(N=C2)C34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C22H26ClN3O2/c1-28-19-5-3-2-4-17(19)12-24-18-13-25-26(21(27)20(18)23)22-9-14-6-15(10-22)8-16(7-14)11-22/h2-5,13-16,24H,6-12H2,1H3