N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-4-methyl-3-nitro-benzamide Formula: C17H17FN2O3S MolecularWeight: 348.391883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2F)[N+](=O)[O-]

InChI

InChI=1S/C17H17FN2O3S/c1-12-6-7-13(10-16(12)20(22)23)17(21)19-8-9-24-11-14-4-2-3-5-15(14)18/h2-7,10H,8-9,11H2,1H3,(H,19,21)