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

Systemtic Name: (4S)-2-(4-fluorophenyl)-5-propyl-4-(thiophen-2-ylmethyliminomethyl)-4H-pyrazol-3-one Openeye Name: (4S)-2-(4-fluorophenyl)-5-propyl-4-(2-thienylmethyliminomethyl)-4H-pyrazol-3-one CAS Name: (4S)-2-(4-fluorophenyl)-5-propyl-4-(thiophen-2-ylmethyliminomethyl)-4H-pyrazol-3-one IUPAC Name: (4S)-2-(4-fluorophenyl)-5-propyl-4-(thiophen-2-ylmethyliminomethyl)-4H-pyrazol-3-one Traditional Name: (4S)-2-(4-fluorophenyl)-5-propyl-4-(2-thenyliminomethyl)-2-pyrazolin-3-one Formula: C18H18FN3OS MolecularWeight: 343.418423

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1C=NCC2=CC=CS2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=NN(C(=O)[C@H]1C=NCC2=CC=CS2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN3OS/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/h3,5-10,12,16H,2,4,11H2,1H3/t16-/m0/s1