N-[[2-(azonan-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: N-[[2-(azonan-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide Openeye Name: N-[[2-(azonan-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide CAS Name: N-[[2-(1-azonanyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[2-(azonan-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide Traditional Name: N-[[2-(azonan-1-yl)-5-(trifluoromethyl)phenyl]thiocarbamoyl]benzamide Formula: C23H26F3N3OS MolecularWeight: 449.53225

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCN(CCC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCCCN(CCC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H26F3N3OS/c24-23(25,26)18-12-13-20(29-14-8-3-1-2-4-9-15-29)19(16-18)27-22(31)28-21(30)17-10-6-5-7-11-17/h5-7,10-13,16H,1-4,8-9,14-15H2,(H2,27,28,30,31)