N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[2-(1-piperidinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]-3-propoxybenzamide Traditional Name: N-[[2-piperidino-5-(trifluoromethyl)phenyl]thiocarbamoyl]-3-propoxy-benzamide Formula: C23H26F3N3O2S MolecularWeight: 465.53165

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3

InChI

InChI=1S/C23H26F3N3O2S/c1-2-13-31-18-8-6-7-16(14-18)21(30)28-22(32)27-19-15-17(23(24,25)26)9-10-20(19)29-11-4-3-5-12-29/h6-10,14-15H,2-5,11-13H2,1H3,(H2,27,28,30,32)