N-(diethylsulfamoyl)-5-(4-fluorophenyl)-4-phenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: N-(diethylsulfamoyl)-5-(4-fluorophenyl)-4-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: N-(diethylsulfamoyl)-5-(4-fluorophenyl)-4-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: N-(diethylsulfamoyl)-5-(4-fluorophenyl)-4-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: N-(diethylsulfamoyl)-5-(4-fluorophenyl)-4-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: N-(diethylsulfamoyl)-3-(4-fluorophenyl)-4-phenyl-2-pyrazoline-1-carbothioamide Formula: C20H23FN4O2S2 MolecularWeight: 434.550623

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)NC(=S)N1CC(C(=N1)C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)NC(=S)N1CC(C(=N1)C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C20H23FN4O2S2/c1-3-24(4-2)29(26,27)23-20(28)25-14-18(15-8-6-5-7-9-15)19(22-25)16-10-12-17(21)13-11-16/h5-13,18H,3-4,14H2,1-2H3,(H,23,28)