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

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(2,3-dimethylcyclohexyl)piperidine-3-carboxamide Openeye Name: N-(2,3-dimethylcyclohexyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide CAS Name: N-(2,3-dimethylcyclohexyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-piperidinecarboxamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-(2,3-dimethylcyclohexyl)nipecotamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H29N3O3S/c1-14-7-5-10-18(15(14)2)22-21(25)16-8-6-12-24(13-16)20-17-9-3-4-11-19(17)28(26,27)23-20/h3-4,9,11,14-16,18H,5-8,10,12-13H2,1-2H3,(H,22,25)