N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(2-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(2-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(2-fluorophenyl)sulfanyl-acetamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-[(2-fluorophenyl)thio]acetamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-(2-fluorophenyl)sulfanylacetamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-[(2-fluorophenyl)thio]acetamide Formula: C18H19FN2O5S MolecularWeight: 394.417263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CSC2=CC=CC=C2F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CSC2=CC=CC=C2F)[N+](=O)[O-])OC

InChI

InChI=1S/C18H19FN2O5S/c1-25-15-9-12(14(21(23)24)10-16(15)26-2)7-8-20-18(22)11-27-17-6-4-3-5-13(17)19/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,22)