1-[[2-(phenylsulfonylamino)-1,3-benzothiazol-6-yl]carbonyl]piperidine-4-carboxamide

Systemtic Name: 1-[[2-(phenylsulfonylamino)-1,3-benzothiazol-6-yl]carbonyl]piperidine-4-carboxamide Openeye Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazole-6-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2-(benzenesulfonamido)-1,3-benzothiazol-6-yl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazole-6-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazole-6-carbonyl]isonipecotamide Formula: C20H20N4O4S2 MolecularWeight: 444.5272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=CC3=C(C=C2)N=C(S3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=CC3=C(C=C2)N=C(S3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O4S2/c21-18(25)13-8-10-24(11-9-13)19(26)14-6-7-16-17(12-14)29-20(22-16)23-30(27,28)15-4-2-1-3-5-15/h1-7,12-13H,8-11H2,(H2,21,25)(H,22,23)