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

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[2-(methylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-methylsulfanylphenyl)piperidine-3-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-[2-(methylthio)phenyl]nipecotamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H21N3O3S2/c1-27-17-10-4-3-9-16(17)21-20(24)14-7-6-12-23(13-14)19-15-8-2-5-11-18(15)28(25,26)22-19/h2-5,8-11,14H,6-7,12-13H2,1H3,(H,21,24)