5-(1,2-dithiolan-3-yl)-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]pentanamide

Systemtic Name: 5-(1,2-dithiolan-3-yl)-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]pentanamide Openeye Name: 5-(dithiolan-3-yl)-N-[[2-(morpholinosulfonylmethyl)phenyl]methyl]pentanamide CAS Name: 5-(3-dithiolanyl)-N-[[2-(4-morpholinylsulfonylmethyl)phenyl]methyl]pentanamide IUPAC Name: 5-(dithiolan-3-yl)-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]pentanamide Traditional Name: 5-(dithiolan-3-yl)-N-[2-(morpholinosulfonylmethyl)benzyl]valeramide Formula: C20H30N2O4S3 MolecularWeight: 458.6582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSSC1CCCCC(=O)NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3

Isomeric SMILES

C1CSSC1CCCCC(=O)NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H30N2O4S3/c23-20(8-4-3-7-19-9-14-27-28-19)21-15-17-5-1-2-6-18(17)16-29(24,25)22-10-12-26-13-11-22/h1-2,5-6,19H,3-4,7-16H2,(H,21,23)