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

Systemtic Name: 4-[butyl(ethyl)sulfamoyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Openeye Name: 4-[butyl(ethyl)sulfamoyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide CAS Name: 4-[butyl(ethyl)sulfamoyl]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-[butyl(ethyl)sulfamoyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Traditional Name: 4-[butyl(ethyl)sulfamoyl]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide Formula: C21H25N3O3S3 MolecularWeight: 463.6365

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3S3/c1-4-6-13-24(5-2)30(26,27)17-10-7-15(8-11-17)20(25)22-16-9-12-18-19(14-16)29-21(23-18)28-3/h7-12,14H,4-6,13H2,1-3H3,(H,22,25)