3-phenyl-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: 3-phenyl-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]prop-2-enamide Openeye Name: 3-phenyl-N-[[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]carbamothioyl]prop-2-enamide CAS Name: 3-phenyl-N-[[2-(1-piperidinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-phenyl-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: 3-phenyl-N-[[2-piperidino-5-(trifluoromethyl)phenyl]thiocarbamoyl]acrylamide Formula: C22H22F3N3OS MolecularWeight: 433.48979

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C=CC3=CC=CC=C3

InChI

InChI=1S/C22H22F3N3OS/c23-22(24,25)17-10-11-19(28-13-5-2-6-14-28)18(15-17)26-21(30)27-20(29)12-9-16-7-3-1-4-8-16/h1,3-4,7-12,15H,2,5-6,13-14H2,(H2,26,27,29,30)