N-(4-tert-butylphenyl)-6-chloranyl-3-[(4-fluorophenyl)methylamino]pyridazine-4-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-6-chloranyl-3-[(4-fluorophenyl)methylamino]pyridazine-4-carboxamide Openeye Name: N-(4-tert-butylphenyl)-6-chloro-3-[(4-fluorophenyl)methylamino]pyridazine-4-carboxamide CAS Name: N-(4-tert-butylphenyl)-6-chloro-3-[(4-fluorophenyl)methylamino]-4-pyridazinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-6-chloro-3-[(4-fluorophenyl)methylamino]pyridazine-4-carboxamide Traditional Name: N-(4-tert-butylphenyl)-6-chloro-3-[(4-fluorobenzyl)amino]pyridazine-4-carboxamide Formula: C22H22ClFN4O MolecularWeight: 412.887683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC(=NN=C2NCC3=CC=C(C=C3)F)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC(=NN=C2NCC3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C22H22ClFN4O/c1-22(2,3)15-6-10-17(11-7-15)26-21(29)18-12-19(23)27-28-20(18)25-13-14-4-8-16(24)9-5-14/h4-12H,13H2,1-3H3,(H,25,28)(H,26,29)