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

Systemtic Name: N-(1-adamantylmethyl)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-methyl-piperidine-3-carboxamide Openeye Name: N-(1-adamantylmethyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-methyl-piperidine-3-carboxamide CAS Name: N-(1-adamantylmethyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-methyl-3-piperidinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-methylpiperidine-3-carboxamide Traditional Name: N-(1-adamantylmethyl)-1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-methyl-nipecotamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC12CC3CC(C1)CC(C3)C2)C(=O)C4CCCN(C4)C5=NS(=O)(=O)C6=CC=CC=C65

Isomeric SMILES

CN(CC12CC3CC(C1)CC(C3)C2)C(=O)C4CCCN(C4)C5=NS(=O)(=O)C6=CC=CC=C65

InChI

InChI=1S/C25H33N3O3S/c1-27(16-25-12-17-9-18(13-25)11-19(10-17)14-25)24(29)20-5-4-8-28(15-20)23-21-6-2-3-7-22(21)32(30,31)26-23/h2-3,6-7,17-20H,4-5,8-16H2,1H3