4-(azepan-1-ylsulfonyl)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]benzamide Formula: C22H26N4O5S3 MolecularWeight: 522.66064

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H26N4O5S3/c1-25(2)33(28,29)18-11-12-19-20(15-18)32-22(23-19)24-21(27)16-7-9-17(10-8-16)34(30,31)26-13-5-3-4-6-14-26/h7-12,15H,3-6,13-14H2,1-2H3,(H,23,24,27)