2,3,5,6-tetrakis(fluoranyl)-4-methoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 2,3,5,6-tetrakis(fluoranyl)-4-methoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 2,3,5,6-tetrafluoro-4-methoxy-N-[[4-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 2,3,5,6-tetrafluoro-4-methoxy-N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,3,5,6-tetrafluoro-4-methoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 2,3,5,6-tetrafluoro-4-methoxy-N-[(4-piperidinophenyl)thiocarbamoyl]benzamide Formula: C20H19F4N3O2S MolecularWeight: 441.442373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1F)F)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3)F)F

Isomeric SMILES

COC1=C(C(=C(C(=C1F)F)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3)F)F

InChI

InChI=1S/C20H19F4N3O2S/c1-29-18-16(23)14(21)13(15(22)17(18)24)19(28)26-20(30)25-11-5-7-12(8-6-11)27-9-3-2-4-10-27/h5-8H,2-4,9-10H2,1H3,(H2,25,26,28,30)