4-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(ethanoylsulfamoyl)phenyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(ethanoylsulfamoyl)phenyl]butanamide Openeye Name: N-[4-(acetylsulfamoyl)phenyl]-4-(1,3-benzothiazol-2-ylsulfanyl)butanamide CAS Name: N-[4-(acetylsulfamoyl)phenyl]-4-(1,3-benzothiazol-2-ylthio)butanamide IUPAC Name: N-[4-(acetylsulfamoyl)phenyl]-4-(1,3-benzothiazol-2-ylsulfanyl)butanamide Traditional Name: N-[4-(acetylsulfamoyl)phenyl]-4-(1,3-benzothiazol-2-ylthio)butyramide Formula: C19H19N3O4S3 MolecularWeight: 449.56686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N3O4S3/c1-13(23)22-29(25,26)15-10-8-14(9-11-15)20-18(24)7-4-12-27-19-21-16-5-2-3-6-17(16)28-19/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,20,24)(H,22,23)