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

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-[2-(dimethylsulfamoyl)benzyl]butyramide Formula: C20H23N3O3S3 MolecularWeight: 449.60992

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC=C1CNC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC=C1CNC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H23N3O3S3/c1-23(2)29(25,26)18-11-6-3-8-15(18)14-21-19(24)12-7-13-27-20-22-16-9-4-5-10-17(16)28-20/h3-6,8-11H,7,12-14H2,1-2H3,(H,21,24)