(4S)-4-(3-ethoxypropyliminomethyl)-2-(4-fluorophenyl)-5-propyl-4H-pyrazol-3-one

Systemtic Name: (4S)-4-(3-ethoxypropyliminomethyl)-2-(4-fluorophenyl)-5-propyl-4H-pyrazol-3-one Openeye Name: (4S)-4-(3-ethoxypropyliminomethyl)-2-(4-fluorophenyl)-5-propyl-4H-pyrazol-3-one CAS Name: (4S)-4-(3-ethoxypropyliminomethyl)-2-(4-fluorophenyl)-5-propyl-4H-pyrazol-3-one IUPAC Name: (4S)-4-(3-ethoxypropyliminomethyl)-2-(4-fluorophenyl)-5-propyl-4H-pyrazol-3-one Traditional Name: (4S)-4-(3-ethoxypropyliminomethyl)-2-(4-fluorophenyl)-5-propyl-2-pyrazolin-3-one Formula: C18H24FN3O2 MolecularWeight: 333.400463

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1C=NCCCOCC)C2=CC=C(C=C2)F

Isomeric SMILES

CCCC1=NN(C(=O)[C@H]1C=NCCCOCC)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H24FN3O2/c1-3-6-17-16(13-20-11-5-12-24-4-2)18(23)22(21-17)15-9-7-14(19)8-10-15/h7-10,13,16H,3-6,11-12H2,1-2H3/t16-/m0/s1