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

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-prop-2-ynyl-piperidine-3-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-prop-2-ynyl-piperidine-3-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-prop-2-ynyl-3-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-prop-2-ynylpiperidine-3-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-propargyl-nipecotamide Formula: C16H17N3O3S MolecularWeight: 331.38948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C1CCCN(C1)C2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C#CCNC(=O)C1CCCN(C1)C2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H17N3O3S/c1-2-9-17-16(20)12-6-5-10-19(11-12)15-13-7-3-4-8-14(13)23(21,22)18-15/h1,3-4,7-8,12H,5-6,9-11H2,(H,17,20)