5-(4-chlorophenyl)-N-(diethylsulfamoyl)-4-pyridin-4-yl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-(4-chlorophenyl)-N-(diethylsulfamoyl)-4-pyridin-4-yl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(4-chlorophenyl)-N-(diethylsulfamoyl)-4-(4-pyridyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(4-chlorophenyl)-N-(diethylsulfamoyl)-4-pyridin-4-yl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(4-chlorophenyl)-N-(diethylsulfamoyl)-4-pyridin-4-yl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(4-chlorophenyl)-N-(diethylsulfamoyl)-4-(4-pyridyl)-2-pyrazoline-1-carbothioamide Formula: C19H22ClN5O2S2 MolecularWeight: 451.99328

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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)Cl)C3=CC=NC=C3

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClN5O2S2/c1-3-24(4-2)29(26,27)23-19(28)25-13-17(14-9-11-21-12-10-14)18(22-25)15-5-7-16(20)8-6-15/h5-12,17H,3-4,13H2,1-2H3,(H,23,28)