N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-4,5-dimethoxy-2-nitro-benzamide Formula: C18H19FN2O5S MolecularWeight: 394.417263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NCCSCC2=CC=CC=C2F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NCCSCC2=CC=CC=C2F)[N+](=O)[O-])OC

InChI

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