(4Z)-4-[1-(tert-butylamino)ethylidene]-2-(4-fluorophenyl)-5-propyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-2-(4-fluorophenyl)-5-propyl-pyrazol-3-one Openeye Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-2-(4-fluorophenyl)-5-propyl-pyrazol-3-one CAS Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-2-(4-fluorophenyl)-5-propyl-3-pyrazolone IUPAC Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-2-(4-fluorophenyl)-5-propylpyrazol-3-one Traditional Name: (4Z)-4-[1-(tert-butylamino)ethylidene]-2-(4-fluorophenyl)-5-propyl-2-pyrazolin-3-one Formula: C18H24FN3O MolecularWeight: 317.401063

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NC(C)(C)C)C2=CC=C(C=C2)F

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NC(C)(C)C)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H24FN3O/c1-6-7-15-16(12(2)20-18(3,4)5)17(23)22(21-15)14-10-8-13(19)9-11-14/h8-11,20H,6-7H2,1-5H3/b16-12-