1-(2,5-dimethylthiophen-3-yl)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-ethanone Openeye Name: 1-(2,5-dimethyl-3-thienyl)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-ethanone CAS Name: 1-(2,5-dimethyl-3-thiophenyl)-2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]ethanone IUPAC Name: 1-(2,5-dimethylthiophen-3-yl)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanone Traditional Name: 1-(2,5-dimethyl-3-thienyl)-2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]ethanone Formula: C22H17FN2OS2 MolecularWeight: 408.511583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN2OS2/c1-13-11-19(14(2)28-13)20(26)12-27-22-18-6-4-3-5-17(18)21(24-25-22)15-7-9-16(23)10-8-15/h3-11H,12H2,1-2H3