5-(4-chlorophenyl)-N-[(1-methylpiperidin-4-yl)methylsulfamoyl]-4-phenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-(4-chlorophenyl)-N-[(1-methylpiperidin-4-yl)methylsulfamoyl]-4-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(4-chlorophenyl)-N-[(1-methyl-4-piperidyl)methylsulfamoyl]-4-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(4-chlorophenyl)-N-[(1-methyl-4-piperidinyl)methylsulfamoyl]-4-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(4-chlorophenyl)-N-[(1-methylpiperidin-4-yl)methylsulfamoyl]-4-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(4-chlorophenyl)-N-[(1-methyl-4-piperidyl)methylsulfamoyl]-4-phenyl-2-pyrazoline-1-carbothioamide Formula: C23H28ClN5O2S2 MolecularWeight: 506.08372

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CNS(=O)(=O)NC(=S)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CN1CCC(CC1)CNS(=O)(=O)NC(=S)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H28ClN5O2S2/c1-28-13-11-17(12-14-28)15-25-33(30,31)27-23(32)29-16-21(18-5-3-2-4-6-18)22(26-29)19-7-9-20(24)10-8-19/h2-10,17,21,25H,11-16H2,1H3,(H,27,32)