1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(5-tert-butyl-2-methoxy-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(5-tert-butyl-2-methoxy-phenyl)piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(5-tert-butyl-2-methoxy-phenyl)piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(5-tert-butyl-2-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(5-tert-butyl-2-methoxyphenyl)piperidine-4-carboxamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C23H28N4O4S2 MolecularWeight: 488.62282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C23H28N4O4S2/c1-23(2,3)16-8-9-19(31-4)18(14-16)24-22(28)15-10-12-27(13-11-15)33(29,30)20-7-5-6-17-21(20)26-32-25-17/h5-9,14-15H,10-13H2,1-4H3,(H,24,28)