N-[5-(diethylsulfamoyl)-2-oxidanyl-phenyl]-5-[(3S)-1,2-dithiolan-3-yl]pentanamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-oxidanyl-phenyl]-5-[(3S)-1,2-dithiolan-3-yl]pentanamide Openeye Name: N-[5-(diethylsulfamoyl)-2-hydroxy-phenyl]-5-[(3S)-dithiolan-3-yl]pentanamide CAS Name: N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-5-[(3S)-3-dithiolanyl]pentanamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-5-[(3S)-dithiolan-3-yl]pentanamide Traditional Name: N-[5-(diethylsulfamoyl)-2-hydroxy-phenyl]-5-[(3S)-dithiolan-3-yl]valeramide Formula: C18H28N2O4S3 MolecularWeight: 432.62092

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CCCCC2CCSS2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CCCC[C@H]2CCSS2

InChI

InChI=1S/C18H28N2O4S3/c1-3-20(4-2)27(23,24)15-9-10-17(21)16(13-15)19-18(22)8-6-5-7-14-11-12-25-26-14/h9-10,13-14,21H,3-8,11-12H2,1-2H3,(H,19,22)/t14-/m0/s1