N-[3-[5-chloranyl-4-[(4-fluorophenyl)amino]-6-oxidanylidene-pyridazin-1-yl]-1-adamantyl]ethanamide

Systemtic Name: N-[3-[5-chloranyl-4-[(4-fluorophenyl)amino]-6-oxidanylidene-pyridazin-1-yl]-1-adamantyl]ethanamide Openeye Name: N-[3-[5-chloro-4-(4-fluoroanilino)-6-oxo-pyridazin-1-yl]-1-adamantyl]acetamide CAS Name: N-[3-[5-chloro-4-(4-fluoroanilino)-6-oxo-1-pyridazinyl]-1-adamantyl]acetamide IUPAC Name: N-[3-[5-chloro-4-(4-fluoroanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetamide Traditional Name: N-[3-[5-chloro-4-(4-fluoroanilino)-6-keto-pyridazin-1-yl]-1-adamantyl]acetamide Formula: C22H24ClFN4O2 MolecularWeight: 430.902963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)N4C(=O)C(=C(C=N4)NC5=CC=C(C=C5)F)Cl

Isomeric SMILES

CC(=O)NC12CC3CC(C1)CC(C3)(C2)N4C(=O)C(=C(C=N4)NC5=CC=C(C=C5)F)Cl

InChI

InChI=1S/C22H24ClFN4O2/c1-13(29)27-21-7-14-6-15(8-21)10-22(9-14,12-21)28-20(30)19(23)18(11-25-28)26-17-4-2-16(24)3-5-17/h2-5,11,14-15,26H,6-10,12H2,1H3,(H,27,29)