[4-[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone Openeye Name: [4-[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone CAS Name: [4-[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-1-piperazinyl]-[3-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-[3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methylpiperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone Traditional Name: [4-[3-(4-chlorobenzyl)-1,2,4-thiadiazol-5-yl]-2-methyl-piperazino]-[3-(trifluoromethyl)phenyl]methanone Formula: C22H20ClF3N4OS MolecularWeight: 480.93361

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC(=CC=C2)C(F)(F)F)C3=NC(=NS3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC(=CC=C2)C(F)(F)F)C3=NC(=NS3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClF3N4OS/c1-14-13-29(21-27-19(28-32-21)11-15-5-7-18(23)8-6-15)9-10-30(14)20(31)16-3-2-4-17(12-16)22(24,25)26/h2-8,12,14H,9-11,13H2,1H3