3-phenyl-2-sulfanylidene-N-[4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-1H-imidazole-4-carboxamide

Systemtic Name: 3-phenyl-2-sulfanylidene-N-[4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-1H-imidazole-4-carboxamide Openeye Name: 3-phenyl-2-thioxo-N-[4-(2,2,2-trifluoroethoxy)phenyl]-1H-imidazole-4-carboxamide CAS Name: 3-phenyl-2-sulfanylidene-N-[4-(2,2,2-trifluoroethoxy)phenyl]-1H-imidazole-4-carboxamide IUPAC Name: 3-phenyl-2-sulfanylidene-N-[4-(2,2,2-trifluoroethoxy)phenyl]-1H-imidazole-4-carboxamide Traditional Name: 3-phenyl-2-thioxo-N-[4-(2,2,2-trifluoroethoxy)phenyl]-4-imidazoline-4-carboxamide Formula: C18H14F3N3O2S MolecularWeight: 393.38287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CNC2=S)C(=O)NC3=CC=C(C=C3)OCC(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CNC2=S)C(=O)NC3=CC=C(C=C3)OCC(F)(F)F

InChI

InChI=1S/C18H14F3N3O2S/c19-18(20,21)11-26-14-8-6-12(7-9-14)23-16(25)15-10-22-17(27)24(15)13-4-2-1-3-5-13/h1-10H,11H2,(H,22,27)(H,23,25)