4-[[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]methylcarbamothioylamino]benzamide

Systemtic Name: 4-[[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]methylcarbamothioylamino]benzamide Openeye Name: 4-[[4-(1-piperidyl)-3-(trifluoromethyl)phenyl]methylcarbamothioylamino]benzamide CAS Name: 4-[[[[4-(1-piperidinyl)-3-(trifluoromethyl)phenyl]methylamino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 4-[[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]methylcarbamothioylamino]benzamide Traditional Name: 4-[[4-piperidino-3-(trifluoromethyl)benzyl]thiocarbamoylamino]benzamide Formula: C21H23F3N4OS MolecularWeight: 436.49373

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)CNC(=S)NC3=CC=C(C=C3)C(=O)N)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)CNC(=S)NC3=CC=C(C=C3)C(=O)N)C(F)(F)F

InChI

InChI=1S/C21H23F3N4OS/c22-21(23,24)17-12-14(4-9-18(17)28-10-2-1-3-11-28)13-26-20(30)27-16-7-5-15(6-8-16)19(25)29/h4-9,12H,1-3,10-11,13H2,(H2,25,29)(H2,26,27,30)