N-[3-(4-fluorophenyl)sulfanylpropyl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[3-[(4-fluorophenyl)thio]propyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[3-[(4-fluorophenyl)thio]propyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C16H17FN2O4S2 MolecularWeight: 384.445583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCSC2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCSC2=CC=C(C=C2)F

InChI

InChI=1S/C16H17FN2O4S2/c1-12-3-6-14(19(20)21)11-16(12)25(22,23)18-9-2-10-24-15-7-4-13(17)5-8-15/h3-8,11,18H,2,9-10H2,1H3