1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-ethylhexyl)piperidine-4-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-ethylhexyl)piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-ethylhexyl)piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-ethylhexyl)-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-ethylhexyl)piperidine-4-carboxamide Traditional Name: N-(2-ethylhexyl)-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C20H30N4O3S2 MolecularWeight: 438.6072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CCCCC(CC)CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C20H30N4O3S2/c1-3-5-7-15(4-2)14-21-20(25)16-10-12-24(13-11-16)29(26,27)18-9-6-8-17-19(18)23-28-22-17/h6,8-9,15-16H,3-5,7,10-14H2,1-2H3,(H,21,25)