4-(1,3-benzothiazol-2-yl)-N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[[5-(dimethylsulfamoyl)-2-thienyl]methyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[[5-(dimethylsulfamoyl)-2-thiophenyl]methyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[[5-(dimethylsulfamoyl)-2-thienyl]methyl]butyramide Formula: C18H21N3O3S3 MolecularWeight: 423.57264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(S1)CNC(=O)CCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(S1)CNC(=O)CCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H21N3O3S3/c1-21(2)27(23,24)18-11-10-13(25-18)12-19-16(22)8-5-9-17-20-14-6-3-4-7-15(14)26-17/h3-4,6-7,10-11H,5,8-9,12H2,1-2H3,(H,19,22)