N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(4-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(4-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(4-fluorophenyl)sulfanyl-acetamide CAS Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(4-fluorophenyl)thio]acetamide IUPAC Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(4-fluorophenyl)sulfanylacetamide Traditional Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(4-fluorophenyl)thio]acetamide Formula: C13H14FN3OS MolecularWeight: 279.333163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NC(=O)CSC2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C(=NN1)C)NC(=O)CSC2=CC=C(C=C2)F

InChI

InChI=1S/C13H14FN3OS/c1-8-13(9(2)17-16-8)15-12(18)7-19-11-5-3-10(14)4-6-11/h3-6H,7H2,1-2H3,(H,15,18)(H,16,17)