N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]piperidine-3-carboxamide Traditional Name: 1-besyl-N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]nipecotamide Formula: C21H24N4O5S3 MolecularWeight: 508.63406

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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)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4O5S3/c1-24(2)32(27,28)17-10-11-18-19(13-17)31-21(22-18)23-20(26)15-7-6-12-25(14-15)33(29,30)16-8-4-3-5-9-16/h3-5,8-11,13,15H,6-7,12,14H2,1-2H3,(H,22,23,26)