2-(4-fluorophenyl)-4-[[[(2R)-oxolan-2-yl]methylamino]methylidene]-5-propyl-pyrazol-3-one

Systemtic Name: 2-(4-fluorophenyl)-4-[[[(2R)-oxolan-2-yl]methylamino]methylidene]-5-propyl-pyrazol-3-one Openeye Name: 2-(4-fluorophenyl)-5-propyl-4-[[[(2R)-tetrahydrofuran-2-yl]methylamino]methylene]pyrazol-3-one CAS Name: 2-(4-fluorophenyl)-4-[[[(2R)-2-oxolanyl]methylamino]methylidene]-5-propyl-3-pyrazolone IUPAC Name: 2-(4-fluorophenyl)-4-[[[(2R)-oxolan-2-yl]methylamino]methylidene]-5-propylpyrazol-3-one Traditional Name: 2-(4-fluorophenyl)-5-propyl-4-[[[(2R)-tetrahydrofuran-2-yl]methylamino]methylene]-2-pyrazolin-3-one Formula: C18H22FN3O2 MolecularWeight: 331.384583

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=CNCC2CCCO2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=NN(C(=O)C1=CNC[C@H]2CCCO2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN3O2/c1-2-4-17-16(12-20-11-15-5-3-10-24-15)18(23)22(21-17)14-8-6-13(19)7-9-14/h6-9,12,15,20H,2-5,10-11H2,1H3/t15-/m1/s1