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

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[(3-methoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-m-anisyl-isonipecotamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H23N3O4S/c1-28-17-6-4-5-15(13-17)14-22-21(25)16-9-11-24(12-10-16)20-18-7-2-3-8-19(18)29(26,27)23-20/h2-8,13,16H,9-12,14H2,1H3,(H,22,25)