4-[butyl(methyl)sulfamoyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 4-[butyl(methyl)sulfamoyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Openeye Name: 4-[butyl(methyl)sulfamoyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide CAS Name: 4-[butyl(methyl)sulfamoyl]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-[butyl(methyl)sulfamoyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Traditional Name: 4-[butyl(methyl)sulfamoyl]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide Formula: C20H23N3O3S3 MolecularWeight: 449.60992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C20H23N3O3S3/c1-4-5-12-23(2)29(25,26)16-9-6-14(7-10-16)19(24)21-15-8-11-17-18(13-15)28-20(22-17)27-3/h6-11,13H,4-5,12H2,1-3H3,(H,21,24)