(3S)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-[2-(methylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-[2-(methylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[2-(methylamino)-2-oxo-ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[2-(methylamino)-2-oxoethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[2-(methylamino)-2-oxoethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-[2-keto-2-(methylamino)ethyl]nipecotamide Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNC(=O)C1CCCN(C1)C2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CNC(=O)CNC(=O)[C@H]1CCCN(C1)C2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H20N4O4S/c1-17-14(21)9-18-16(22)11-5-4-8-20(10-11)15-12-6-2-3-7-13(12)25(23,24)19-15/h2-3,6-7,11H,4-5,8-10H2,1H3,(H,17,21)(H,18,22)/t11-/m0/s1