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

Systemtic Name: (3R)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-cycloheptyl-piperidine-3-carboxamide Openeye Name: (3R)-N-cycloheptyl-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide CAS Name: (3R)-N-cycloheptyl-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-piperidinecarboxamide IUPAC Name: (3R)-N-cycloheptyl-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide Traditional Name: (3R)-N-cycloheptyl-1-(1,1-diketo-1,2-benzothiazol-3-yl)nipecotamide Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCCC(CC1)NC(=O)[C@@H]2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H27N3O3S/c24-20(21-16-9-3-1-2-4-10-16)15-8-7-13-23(14-15)19-17-11-5-6-12-18(17)27(25,26)22-19/h5-6,11-12,15-16H,1-4,7-10,13-14H2,(H,21,24)/t15-/m1/s1