4-methyl-N-[(2S)-4-methyl-1-[2-(2-oxidanylidenebutyl)-1,3-dithiolan-2-yl]pentan-2-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(2S)-4-methyl-1-[2-(2-oxidanylidenebutyl)-1,3-dithiolan-2-yl]pentan-2-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[(1S)-3-methyl-1-[[2-(2-oxobutyl)-1,3-dithiolan-2-yl]methyl]butyl]benzenesulfonamide CAS Name: 4-methyl-N-[(2S)-4-methyl-1-[2-(2-oxobutyl)-1,3-dithiolan-2-yl]pentan-2-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(2S)-4-methyl-1-[2-(2-oxobutyl)-1,3-dithiolan-2-yl]pentan-2-yl]benzenesulfonamide Traditional Name: N-[(1S)-1-[[2-(2-ketobutyl)-1,3-dithiolan-2-yl]methyl]-3-methyl-butyl]-4-methyl-benzenesulfonamide Formula: C20H31NO3S3 MolecularWeight: 429.66004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1(SCCS1)CC(CC(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(=O)CC1(SCCS1)C[C@H](CC(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H31NO3S3/c1-5-18(22)14-20(25-10-11-26-20)13-17(12-15(2)3)21-27(23,24)19-8-6-16(4)7-9-19/h6-9,15,17,21H,5,10-14H2,1-4H3/t17-/m0/s1