1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(2-ethyl-6-methyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(2-ethyl-6-methyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-ethyl-6-methyl-phenyl)piperidine-4-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-ethyl-6-methylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-ethyl-6-methylphenyl)piperidine-4-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-(2-ethyl-6-methyl-phenyl)isonipecotamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C22H25N3O3S/c1-3-16-8-6-7-15(2)20(16)23-22(26)17-11-13-25(14-12-17)21-18-9-4-5-10-19(18)29(27,28)24-21/h4-10,17H,3,11-14H2,1-2H3,(H,23,26)