2-[5,5-dimethyl-2-(2-phenyl-2-sulfanylidene-ethyl)sulfanyl-imidazol-4-yl]sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-[5,5-dimethyl-2-(2-phenyl-2-sulfanylidene-ethyl)sulfanyl-imidazol-4-yl]sulfanyl-1-phenyl-ethanone Openeye Name: 2-[5,5-dimethyl-2-(2-phenyl-2-thioxo-ethyl)sulfanyl-imidazol-4-yl]sulfanyl-1-phenyl-ethanone CAS Name: 2-[[5,5-dimethyl-2-[(2-phenyl-2-sulfanylideneethyl)thio]-4-imidazolyl]thio]-1-phenylethanone IUPAC Name: 2-[5,5-dimethyl-2-(2-phenyl-2-sulfanylideneethyl)sulfanylimidazol-4-yl]sulfanyl-1-phenylethanone Traditional Name: 2-[[5,5-dimethyl-2-[(2-phenyl-2-thioxo-ethyl)thio]imidazol-4-yl]thio]-1-phenyl-ethanone Formula: C21H20N2OS3 MolecularWeight: 412.5913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NC(=N1)SCC(=S)C2=CC=CC=C2)SCC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C(=NC(=N1)SCC(=S)C2=CC=CC=C2)SCC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H20N2OS3/c1-21(2)19(26-13-17(24)15-9-5-3-6-10-15)22-20(23-21)27-14-18(25)16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3