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

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-quinolin-2-yl-piperidine-3-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-quinolyl)piperidine-3-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-quinolinyl)-3-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-quinolin-2-ylpiperidine-3-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-(2-quinolyl)nipecotamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CC(CN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H20N4O3S/c27-22(24-20-12-11-15-6-1-3-9-18(15)23-20)16-7-5-13-26(14-16)21-17-8-2-4-10-19(17)30(28,29)25-21/h1-4,6,8-12,16H,5,7,13-14H2,(H,23,24,27)