1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethoxyphenyl)piperidine-3-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethoxyphenyl)piperidine-3-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethoxyphenyl)piperidine-3-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethoxyphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethoxyphenyl)piperidine-3-carboxamide Traditional Name: N-(3,5-dimethoxyphenyl)-1-piazthiol-4-ylsulfonyl-nipecotamide Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=NSN=C43)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=NSN=C43)OC

InChI

InChI=1S/C20H22N4O5S2/c1-28-15-9-14(10-16(11-15)29-2)21-20(25)13-5-4-8-24(12-13)31(26,27)18-7-3-6-17-19(18)23-30-22-17/h3,6-7,9-11,13H,4-5,8,12H2,1-2H3,(H,21,25)