4-[bis(fluoranyl)methyl]-2-tert-butyl-5-(pyridin-4-ylmethylamino)pyridazin-3-one

Systemtic Name: 4-[bis(fluoranyl)methyl]-2-tert-butyl-5-(pyridin-4-ylmethylamino)pyridazin-3-one Openeye Name: 2-tert-butyl-4-(difluoromethyl)-5-(4-pyridylmethylamino)pyridazin-3-one CAS Name: 2-tert-butyl-4-(difluoromethyl)-5-(pyridin-4-ylmethylamino)-3-pyridazinone IUPAC Name: 2-tert-butyl-4-(difluoromethyl)-5-(pyridin-4-ylmethylamino)pyridazin-3-one Traditional Name: 2-tert-butyl-4-(difluoromethyl)-5-(4-pyridylmethylamino)pyridazin-3-one Formula: C15H18F2N4O MolecularWeight: 308.326426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C=N1)NCC2=CC=NC=C2)C(F)F

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C=N1)NCC2=CC=NC=C2)C(F)F

InChI

InChI=1S/C15H18F2N4O/c1-15(2,3)21-14(22)12(13(16)17)11(9-20-21)19-8-10-4-6-18-7-5-10/h4-7,9,13,19H,8H2,1-3H3