1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(3-pyrrolidin-1-ylcarbonylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(3-pyrrolidin-1-ylcarbonylphenyl)piperidine-4-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[3-[oxo(1-pyrrolidinyl)methyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]isonipecotamide Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)C3CCN(CC3)C4=NS(=O)(=O)C5=CC=CC=C54

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)C3CCN(CC3)C4=NS(=O)(=O)C5=CC=CC=C54

InChI

InChI=1S/C24H26N4O4S/c29-23(25-19-7-5-6-18(16-19)24(30)28-12-3-4-13-28)17-10-14-27(15-11-17)22-20-8-1-2-9-21(20)33(31,32)26-22/h1-2,5-9,16-17H,3-4,10-15H2,(H,25,29)