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

Systemtic Name: (4Z)-2-(4-fluorophenyl)-5-methyl-4-[1-(2-methylpropylamino)ethylidene]pyrazol-3-one Openeye Name: (4Z)-2-(4-fluorophenyl)-4-[1-(isobutylamino)ethylidene]-5-methyl-pyrazol-3-one CAS Name: (4Z)-2-(4-fluorophenyl)-5-methyl-4-[1-(2-methylpropylamino)ethylidene]-3-pyrazolone IUPAC Name: (4Z)-2-(4-fluorophenyl)-5-methyl-4-[1-(2-methylpropylamino)ethylidene]pyrazol-3-one Traditional Name: (4Z)-2-(4-fluorophenyl)-4-[1-(isobutylamino)ethylidene]-5-methyl-2-pyrazolin-3-one Formula: C16H20FN3O MolecularWeight: 289.347903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NCC(C)C)C2=CC=C(C=C2)F

Isomeric SMILES

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

InChI

InChI=1S/C16H20FN3O/c1-10(2)9-18-11(3)15-12(4)19-20(16(15)21)14-7-5-13(17)6-8-14/h5-8,10,18H,9H2,1-4H3/b15-11-