5-(4-chlorophenyl)-N-piperidin-1-ylsulfonyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-(4-chlorophenyl)-N-piperidin-1-ylsulfonyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(4-chlorophenyl)-N-(1-piperidylsulfonyl)-4-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(4-chlorophenyl)-N-(1-piperidinylsulfonyl)-4-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(4-chlorophenyl)-N-piperidin-1-ylsulfonyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(4-chlorophenyl)-N-piperidinosulfonyl-4-[3-(trifluoromethyl)phenyl]-2-pyrazoline-1-carbothioamide Formula: C22H22ClF3N4O2S2 MolecularWeight: 531.01389

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)NC(=S)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)NC(=S)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H22ClF3N4O2S2/c23-18-9-7-15(8-10-18)20-19(16-5-4-6-17(13-16)22(24,25)26)14-30(27-20)21(33)28-34(31,32)29-11-2-1-3-12-29/h4-10,13,19H,1-3,11-12,14H2,(H,28,33)