N-(1-adamantyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1-adamantyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1-adamantyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(1-adamantyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1-adamantyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C26H38N2O3S MolecularWeight: 458.65652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NC34CC5CC(C3)CC(C5)C4)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NC34CC5CC(C3)CC(C5)C4)C)C

InChI

InChI=1S/C26H38N2O3S/c1-16-9-17(2)19(4)24(18(16)3)32(30,31)28-7-5-23(6-8-28)25(29)27-26-13-20-10-21(14-26)12-22(11-20)15-26/h9,20-23H,5-8,10-15H2,1-4H3,(H,27,29)