2-(dimethylamino)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-nitro-benzamide

Systemtic Name: 2-(dimethylamino)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-nitro-benzamide Openeye Name: 2-(dimethylamino)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-nitro-benzamide CAS Name: 2-(dimethylamino)-N-[2-[(2-fluorophenyl)methylthio]ethyl]-5-nitrobenzamide IUPAC Name: 2-(dimethylamino)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-nitrobenzamide Traditional Name: 2-(dimethylamino)-N-[2-[(2-fluorobenzyl)thio]ethyl]-5-nitro-benzamide Formula: C18H20FN3O3S MolecularWeight: 377.433103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20FN3O3S/c1-21(2)17-8-7-14(22(24)25)11-15(17)18(23)20-9-10-26-12-13-5-3-4-6-16(13)19/h3-8,11H,9-10,12H2,1-2H3,(H,20,23)