2-(1-adamantyl)-4-chloranyl-5-(propan-2-ylamino)pyridazin-3-one

Systemtic Name: 2-(1-adamantyl)-4-chloranyl-5-(propan-2-ylamino)pyridazin-3-one Openeye Name: 2-(1-adamantyl)-4-chloro-5-(isopropylamino)pyridazin-3-one CAS Name: 2-(1-adamantyl)-4-chloro-5-(propan-2-ylamino)-3-pyridazinone IUPAC Name: 2-(1-adamantyl)-4-chloro-5-(propan-2-ylamino)pyridazin-3-one Traditional Name: 2-(1-adamantyl)-4-chloro-5-(isopropylamino)pyridazin-3-one Formula: C17H24ClN3O MolecularWeight: 321.84496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C(=O)N(N=C1)C23CC4CC(C2)CC(C4)C3)Cl

Isomeric SMILES

CC(C)NC1=C(C(=O)N(N=C1)C23CC4CC(C2)CC(C4)C3)Cl

InChI

InChI=1S/C17H24ClN3O/c1-10(2)20-14-9-19-21(16(22)15(14)18)17-6-11-3-12(7-17)5-13(4-11)8-17/h9-13,20H,3-8H2,1-2H3