N-[[1-[2-(4-nitrophenyl)sulfanylethanoyl]piperidin-2-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-[2-(4-nitrophenyl)sulfanylethanoyl]piperidin-2-yl]methyl]methanesulfonamide Openeye Name: N-[[1-[2-(4-nitrophenyl)sulfanylacetyl]-2-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-[2-[(4-nitrophenyl)thio]-1-oxoethyl]-2-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[1-[2-(4-nitrophenyl)sulfanylacetyl]piperidin-2-yl]methyl]methanesulfonamide Traditional Name: N-[[1-[2-[(4-nitrophenyl)thio]acetyl]-2-piperidyl]methyl]methanesulfonamide Formula: C15H21N3O5S2 MolecularWeight: 387.47434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1CCCCN1C(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)NCC1CCCCN1C(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O5S2/c1-25(22,23)16-10-13-4-2-3-9-17(13)15(19)11-24-14-7-5-12(6-8-14)18(20)21/h5-8,13,16H,2-4,9-11H2,1H3