N-[2-(2,4-dichlorophenyl)pentyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C18H20Cl2N2O2S MolecularWeight: 399.3346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNC(=O)CSC1=CC=CC=[N+]1[O-])C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCC(CNC(=O)CSC1=CC=CC=[N+]1[O-])C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H20Cl2N2O2S/c1-2-5-13(15-8-7-14(19)10-16(15)20)11-21-17(23)12-25-18-6-3-4-9-22(18)24/h3-4,6-10,13H,2,5,11-12H2,1H3,(H,21,23)