N-(2-adamantyl)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]piperidine-3-carboxamide

Systemtic Name: N-(2-adamantyl)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]piperidine-3-carboxamide Openeye Name: N-(2-adamantyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide CAS Name: N-(2-adamantyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-piperidinecarboxamide IUPAC Name: N-(2-adamantyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide Traditional Name: N-(2-adamantyl)-1-(1,1-diketo-1,2-benzothiazol-3-yl)nipecotamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4C5CC6CC(C5)CC4C6

Isomeric SMILES

C1CC(CN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C23H29N3O3S/c27-23(24-21-17-9-14-8-15(11-17)12-18(21)10-14)16-4-3-7-26(13-16)22-19-5-1-2-6-20(19)30(28,29)25-22/h1-2,5-6,14-18,21H,3-4,7-13H2,(H,24,27)