N-[3-(4-fluorophenyl)sulfanylpropyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-4-methylsulfonyl-benzamide Openeye Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-4-methylsulfonyl-benzamide CAS Name: N-[3-[(4-fluorophenyl)thio]propyl]-4-methylsulfonylbenzamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-4-methylsulfonylbenzamide Traditional Name: N-[3-[(4-fluorophenyl)thio]propyl]-4-mesyl-benzamide Formula: C17H18FNO3S2 MolecularWeight: 367.458123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCCSC2=CC=C(C=C2)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCCSC2=CC=C(C=C2)F

InChI

InChI=1S/C17H18FNO3S2/c1-24(21,22)16-9-3-13(4-10-16)17(20)19-11-2-12-23-15-7-5-14(18)6-8-15/h3-10H,2,11-12H2,1H3,(H,19,20)