1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(5-tert-butyl-2-methoxy-phenyl)piperidine-3-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(5-tert-butyl-2-methoxy-phenyl)piperidine-3-carboxamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-3-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-3-carboxamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(1,1-diketo-1,2-benzothiazol-3-yl)nipecotamide Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C24H29N3O4S/c1-24(2,3)17-11-12-20(31-4)19(14-17)25-23(28)16-8-7-13-27(15-16)22-18-9-5-6-10-21(18)32(29,30)26-22/h5-6,9-12,14,16H,7-8,13,15H2,1-4H3,(H,25,28)