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

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(3-methyl-2-phenyl-butyl)piperidine-3-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(3-methyl-2-phenyl-butyl)piperidine-3-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(3-methyl-2-phenylbutyl)-3-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(3-methyl-2-phenylbutyl)piperidine-3-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-(3-methyl-2-phenyl-butyl)nipecotamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1CCCN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CNC(=O)C1CCCN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C24H29N3O3S/c1-17(2)21(18-9-4-3-5-10-18)15-25-24(28)19-11-8-14-27(16-19)23-20-12-6-7-13-22(20)31(29,30)26-23/h3-7,9-10,12-13,17,19,21H,8,11,14-16H2,1-2H3,(H,25,28)