3-(acetamidomethylsulfanyl)-N-[3-(butylsulfamoyl)phenyl]propanamide

Systemtic Name: 3-(acetamidomethylsulfanyl)-N-[3-(butylsulfamoyl)phenyl]propanamide Openeye Name: 3-(acetamidomethylsulfanyl)-N-[3-(butylsulfamoyl)phenyl]propanamide CAS Name: 3-(acetamidomethylthio)-N-[3-(butylsulfamoyl)phenyl]propanamide IUPAC Name: 3-(acetamidomethylsulfanyl)-N-[3-(butylsulfamoyl)phenyl]propanamide Traditional Name: 3-(acetamidomethylthio)-N-[3-(butylsulfamoyl)phenyl]propionamide Formula: C16H25N3O4S2 MolecularWeight: 387.5174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=CC(=C1)NC(=O)CCSCNC(=O)C

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=CC(=C1)NC(=O)CCSCNC(=O)C

InChI

InChI=1S/C16H25N3O4S2/c1-3-4-9-18-25(22,23)15-7-5-6-14(11-15)19-16(21)8-10-24-12-17-13(2)20/h5-7,11,18H,3-4,8-10,12H2,1-2H3,(H,17,20)(H,19,21)