N-[(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-2,3,5,6-tetramethyl-benzenesulfonamide

Systemtic Name: N-[(2S)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-2,3,5,6-tetramethyl-benzenesulfonamide Openeye Name: N-[(1S)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]-2,3,5,6-tetramethyl-benzenesulfonamide CAS Name: N-[(2S)-1-(1-azepanyl)-1-oxopropan-2-yl]-2,3,5,6-tetramethylbenzenesulfonamide IUPAC Name: N-[(2S)-1-(azepan-1-yl)-1-oxopropan-2-yl]-2,3,5,6-tetramethylbenzenesulfonamide Traditional Name: N-[(1S)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl]-2,3,5,6-tetramethyl-benzenesulfonamide Formula: C19H30N2O3S MolecularWeight: 366.5181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NC(C)C(=O)N2CCCCCC2)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N[C@@H](C)C(=O)N2CCCCCC2)C)C

InChI

InChI=1S/C19H30N2O3S/c1-13-12-14(2)16(4)18(15(13)3)25(23,24)20-17(5)19(22)21-10-8-6-7-9-11-21/h12,17,20H,6-11H2,1-5H3/t17-/m0/s1