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

Systemtic Name: (4Z)-2-(4-fluorophenyl)-4-[1-(2-methylpropylamino)ethylidene]-5-propyl-pyrazol-3-one Openeye Name: (4Z)-2-(4-fluorophenyl)-4-[1-(isobutylamino)ethylidene]-5-propyl-pyrazol-3-one CAS Name: (4Z)-2-(4-fluorophenyl)-4-[1-(2-methylpropylamino)ethylidene]-5-propyl-3-pyrazolone IUPAC Name: (4Z)-2-(4-fluorophenyl)-4-[1-(2-methylpropylamino)ethylidene]-5-propylpyrazol-3-one Traditional Name: (4Z)-2-(4-fluorophenyl)-4-[1-(isobutylamino)ethylidene]-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)NCC(C)C)C2=CC=C(C=C2)F

Isomeric SMILES

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

InChI

InChI=1S/C18H24FN3O/c1-5-6-16-17(13(4)20-11-12(2)3)18(23)22(21-16)15-9-7-14(19)8-10-15/h7-10,12,20H,5-6,11H2,1-4H3/b17-13-